A0A087XL47_POEFO Loading...

CRK SH3-binding GNRP

AlphaFold DB , UniProt , Accession A0A087XL47, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,183 aa.

						>A0A087XL47_POEFO|A0A087XL47
MSRKIESKQDSQRSHLSTFTMILKDKFHSPKIKRTPSKKAKQLQPEPAAKSTEKPANKKVSRLEEHEKEVVSALKYFKTIVDKMVVEKKVLEMLPGSASKVLEAILPLVQIEARIQHSSALSSCHSRVYQSLGNLIRWADQVMLDGIDLDDKESVIAVTSVIKAVLDGVKELVKLTIEKQEQPSPTTPNKPAPPVTTTESNVSVEVPLIDTEQEVSSRTAPVTSPAKVAPELQDEDVAPPKPPLPEAKVAELSPPPALPPKKRQSAPSPTPVAVVAPMSRGSSLPCSDHRQEYEQEFFQRRFSGGSHSYGGDSPRLSPCSSMGKLSKSDEQLSSMDQDSGQCSRNTSCETLDNTESYDPDYDFLHQDLSAGDNLPAVQVGGCLSPLPESHSESSSPVPGQHLAHPPLSAPPSQQQEYWTPQPNQSNPLQSCRTSAPPALPLKKRRSTQTSSFSDGGSRVLYERYPSQYDNLSEEELHPTPPFPLFTPISPMPQTNGGVFVSQFMASENADVPANPPPLPEKKNRHILQYMQFMEDYSEPQPSVFYQMPQSERIYEQHNKLFQEVYGFNDSFSSTDSVHEPLQPPALPPKQRQLASHSSSPSSSSSSSLSCHLQPSVAALEEAGSGLGLSMSVSNSYLIGQASLTTPTSLDQVALTNATVLDGSGGGPNGSLAGSMGSVAVCLPSESSLTDLLHTSASESVNDEGGEGEYVNLYSSSQANGELPLSLRETIAADDVLQDPVPQMPSSNSKEALDKERRQKTAETAGSVEEDVDELSLIDHKEIMSRITLKQENDDGPDVRAGSGDILLVHATETERKDLVLYCEAFLTTYRTFITPEDLIKKLHYRYTTFCHSPDTFKKRVSKNTFFVLVRVVDELCLVELTEDILKQLMDLVFTLVCNGELSLARVLRKNILDKVEQKKLLRYTNSLKPLAARGVSARPGTLHDFRSHEIADQLTLLDAELFYKIEIPEVLLWAKEQNEEKSPNLTQFTEHFNNMSYWVRSLIIQQEKAQDREKLLLKFIKIMKHLRKLNNFNSYLAILSALDSAPIRRLEWQKQTSEGLEEYCTLIDSSSSFRAYRAALAEVEPPCIPYLGLILQDLTFVHLGNPDLIDGKVNFSKRWQQFNILDSMRRFQQVHYELKRNEEIISFFNDFSDHLAEEALWELSLKIKPRNINRAKTDRGEKT
					

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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	27.1	Very low	25	Very low	233 Å²	233	166.8 Å²	166.8	100%	1.148	84%	0.837	S	S	*	*				0	115.9	0	-66.3	178.6	-178.1	0	0	106.2
2	S	25.2	Very low	25	Very low	110 Å²	110	170.2 Å²	170.2	77%	0.769	85%	0.847	S	S	*	*				71	119.9	81.6	-50.5	0	0	0	0	110.4
3	R	26.2	Very low	24.9	Very low	241 Å²	241	173 Å²	173	91%	0.909	84%	0.842	S	S	*	*			cis	-156.6	177.5	11.5	-88.1	165.2	-178	162.1	-1.9	107.5
4	K	26.6	Very low	25	Very low	167 Å²	167	167.9 Å²	167.9	73%	0.726	83%	0.833	S	S	*	*			cis	173	112.6	-32.9	174.4	-172.4	170.1	-180	0	107.1
5	I	28	Very low	24.9	Very low	140 Å²	140	169.3 Å²	169.3	72%	0.718	84%	0.836	S	S	*	*			trans	67.9	149.4	158.6	-62.3	179.8	0	0	0	113.3
6	E	23.1	Very low	25	Very low	177 Å²	177	169.5 Å²	169.5	83%	0.827	84%	0.84	S	S	*	*			cis	-142.2	161.5	31.5	-157.4	152	-131.8	0	0	115
7	S	24.4	Very low	25.1	Very low	109 Å²	109	166.4 Å²	166.4	76%	0.762	84%	0.839	S	S	*	*			trans	-143.6	142.9	173.9	57.1	0	0	0	0	110.7
8	K	22.9	Very low	25.2	Very low	204 Å²	204	161.4 Å²	161.4	89%	0.887	82%	0.818	S	S	*	*			trans	-132.3	142.8	163.1	-83.8	-167.1	172.1	-171.4	0	110.6
9	Q	24.9	Very low	25.3	Very low	191 Å²	191	162.9 Å²	162.9	89%	0.893	82%	0.819	S	S	*	*			trans	-76.3	157.2	164	-61.8	157.4	-67.4	0	0	109.2
10	D	23.6	Very low	25.5	Very low	168 Å²	168	158.6 Å²	158.6	90%	0.898	80%	0.801	S	S	*	*			trans	-151.9	160.9	137.2	-131.6	-38.3	0	0	0	111.2
11	S	22.6	Very low	25.5	Very low	95 Å²	95	159.1 Å²	159.1	66%	0.664	80%	0.803	S	S	*	*			trans	-94.4	139.2	-165.7	-172.5	0	0	0	0	113.8
12	Q	25.6	Very low	25.5	Very low	207 Å²	207	155 Å²	155	97%	0.967	78%	0.784	S	S	*	*			trans	-96.3	98.3	163.7	-74.1	-158.2	-20.1	0	0	110.3
13	R	23.1	Very low	26.1	Very low	207 Å²	207	158.1 Å²	158.1	78%	0.781	79%	0.791	S	S	*	*			trans	-118.7	123.5	-179.4	-166.3	-173.1	-178	178.8	1.5	109.9
14	S	26.4	Very low	26.1	Very low	102 Å²	102	155.2 Å²	155.2	71%	0.713	79%	0.785	S	S	*	*			trans	33.1	110.8	159.8	62.1	0	0	0	0	118.7
15	H	24	Very low	26	Very low	188 Å²	188	154.2 Å²	154.2	87%	0.87	79%	0.788	S	S	*	*			trans	-125.2	73	170.5	-74.8	-21.7	0	0	0	112.9
16	L	26.5	Very low	26	Very low	173 Å²	173	157.6 Å²	157.6	91%	0.906	80%	0.797	S	S	*	*			trans	-149.5	73.7	157.7	-154.1	76.1	0	0	0	112.6
17	S	27	Very low	26.2	Very low	117 Å²	117	158.5 Å²	158.5	82%	0.818	80%	0.799	S	S	*	*			trans	-157.5	108	157.7	-176.9	0	0	0	0	110.6
18	T	27	Very low	26.4	Very low	76 Å²	76	162.7 Å²	162.7	47%	0.466	81%	0.806	S	S	.	*			trans	153.8	105.5	161	-68.8	0	0	0	0	106.8	K816	T18-K816 HydrophobicContact CG2-CD 4.47Å
19	F	26.4	Very low	26.7	Very low	191 Å²	191	157.6 Å²	157.6	84%	0.838	80%	0.796	S	S	*	*			trans	-125	60	166.8	-160.7	-98.1	0	0	0	111.8
20	T	29.6	Very low	26.9	Very low	76 Å²	76	154.6 Å²	154.6	47%	0.466	79%	0.793	S	S	.	*	S	Bend	trans	-132.5	91.6	163.9	31.5	0	0	0	0	108.8	V819	T20-V819 HydrophobicContact CG2-CG2 3.66Å; T20-V819 VanDerWaalsContact OG1-CG2 3.24Å; T20-V819 WeakPolarHBondContact OG1-CG2 3.48Å
21	M	26.2	Very low	27.1	Very low	169 Å²	169	155.4 Å²	155.4	83%	0.833	79%	0.789	S	S	*	*			trans	67.1	149	-173.3	-53.8	178.7	66.8	0	0	112.7
22	I	27.2	Very low	27.2	Very low	147 Å²	147	157.3 Å²	157.3	75%	0.754	79%	0.79	S	S	*	*			cis	-134.8	133.2	31.7	-68.7	164	0	0	0	112	K24	I22-K24 HydrophobicContact CG2-CB 4.2Å; I22-K24 PolarHBondContact O-N 2.58Å
23	L	36	Very low	27.3	Very low	176 Å²	176	152.8 Å²	152.8	92%	0.921	77%	0.767	S	S	*	*			trans	-81.9	101.7	159.3	-82.8	168.5	0	0	0	110
24	K	27.1	Very low	27.7	Very low	179 Å²	179	150.1 Å²	150.1	78%	0.778	76%	0.757	S	S	*	*			trans	-164	132.6	156.6	-114.4	164.6	-175	176.7	0	113.4	I22	I22-K24 HydrophobicContact CG2-CB 4.2Å; I22-K24 PolarHBondContact O-N 2.58Å
25	D	25.5	Very low	28	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	75%	0.754	S	S	*	*			trans	47.7	99	160.2	-60.7	-36.5	0	0	0	120.9
26	K	26.7	Very low	28.2	Very low	212 Å²	212	147.4 Å²	147.4	92%	0.922	75%	0.752	S	S	*	*			trans	-156.7	65	135.2	-115	166.8	-169.8	174.2	0	114.2
27	F	28.2	Very low	28.4	Very low	195 Å²	195	144.4 Å²	144.4	86%	0.855	75%	0.745	S	S	*	*			trans	-109	112.8	157.9	-91.5	-74	0	0	0	110.3
28	H	27.8	Very low	28.4	Very low	198 Å²	198	148.6 Å²	148.6	92%	0.917	75%	0.749	S	S	*	*			trans	-142.7	100	166.7	-98	56.5	0	0	0	109.1
29	S	30.2	Very low	28.4	Very low	97 Å²	97	154.5 Å²	154.5	68%	0.678	77%	0.768	S	S	*	*			trans	-96.4	154.9	177.7	-64.7	0	0	0	0	111.7
30	P	28.1	Very low	28.4	Very low	128 Å²	128	149.9 Å²	149.9	83%	0.831	77%	0.765	S	S	*	*			trans	-74.9	164.5	-163.3	28.9	-36.6	0	0	0	115.2
31	K	27.4	Very low	28.3	Very low	184 Å²	184	154.9 Å²	154.9	80%	0.8	78%	0.781	S	S	*	*			trans	-130.4	108.1	-179.9	-72.5	174.5	178	164.8	0	112.5
32	I	26.5	Very low	28.3	Very low	136 Å²	136	153.7 Å²	153.7	70%	0.697	77%	0.773	S	S	*	*			trans	-121.5	63.5	167.3	-46.4	-176.4	0	0	0	111.8
33	K	27.6	Very low	28.2	Very low	111 Å²	111	154.6 Å²	154.6	48%	0.483	78%	0.778	S	S	.	*				18.4	126.5	125.6	-82.1	-161.5	173.9	-173.9	0	120.6	A672 G673	K33-A672 HydrophobicContact CD-CB 3.91Å; K33-G673 CarbonylContact C-O 3.52Å; K33-G673 VanDerWaalsContact C-O 3.23Å; K33-G673 WeakPolarHBondContact CA-O 3.3Å; K33-G673 VanDerWaalsContact CB-O 3.23Å; K33-G673 WeakPolarHBondContact CB-O 3.4Å; K33-G673 WeakPolarHBondContact CG-O 3.36Å
34	R	30.5	Very low	27.7	Very low	151 Å²	151	153.9 Å²	153.9	57%	0.57	77%	0.77	S	S	*	*	B	Isolated β-bridge	trans	-32.2	171.2	173	-58.6	168.7	154.5	156.2	-14.7	119.4	G673 S674	R34-G673 WeakPolarHBondContact CB-O 3.26Å; R34-G673 VanDerWaalsContact CG-O 3.29Å; R34-G673 WeakPolarHBondContact CG-O 3.31Å; R34-G673 PolarHBondContact N-O 3.2Å; R34-G673 PolarHBondContact O-N 3.1Å; R34-S674 VanDerWaalsContact CD-O 3.24Å; R34-S674 WeakPolarHBondContact CD-O 3.32Å; R34-S674 PolarHBondContact NE-O 3.4Å; R34-S674 PolarHBondContact NH1-O 3.38Å
35	T	33.4	Very low	28.4	Very low	105 Å²	105	150.5 Å²	150.5	64%	0.644	77%	0.766	S	S	*	*			cis	-168.2	169	35.2	-22.9	0	0	0	0	112.5
36	P	27.5	Very low	28.5	Very low	129 Å²	129	151.4 Å²	151.4	84%	0.838	77%	0.766	S	S	*	*				-147.7	-162.2	90.9	39.2	-19.3	0	0	0	115.5
37	S	30.3	Very low	29.2	Very low	109 Å²	109	146.9 Å²	146.9	76%	0.762	76%	0.758	S	S	*	*			trans	-148.1	152.4	-159.1	172	0	0	0	0	116.3
38	K	27.9	Very low	29.8	Very low	205 Å²	205	142.4 Å²	142.4	89%	0.891	76%	0.758	S	S	*	*			trans	-171	166.2	158.2	-103.1	159.3	-174	176.8	0	111.7
39	K	26.8	Very low	30	Very low	200 Å²	200	137.9 Å²	137.9	87%	0.87	75%	0.754	S	S	*	*				-173.4	97.1	-66.6	176.9	-178.7	179.8	-179.4	0	112.6
40	A	25.4	Very low	30.5	Very low	94 Å²	94	142.8 Å²	142.8	78%	0.777	76%	0.763	S	S	*	*			trans	-161.4	138.2	157.7	0	0	0	0	0	108.1
41	K	27.2	Very low	30.9	Very low	182 Å²	182	142.2 Å²	142.2	79%	0.791	76%	0.763	S	S	*	*				65.4	130.5	54.5	-88.6	-154.8	165.9	-150.9	0	113.6
42	Q	26.9	Very low	31.6	Very low	144 Å²	144	139.9 Å²	139.9	67%	0.673	76%	0.764	S	S	*	*			cis	-166	135.7	0.3	171	174.6	-27.5	0	0	111.2
43	L	25.6	Very low	32.3	Very low	165 Å²	165	138.6 Å²	138.6	86%	0.864	76%	0.755	S	S	*	*			trans	-178.3	152.7	142.7	-100.9	158.5	0	0	0	112.4
44	Q	25.2	Very low	33.1	Very low	162 Å²	162	140.8 Å²	140.8	76%	0.757	76%	0.764	S	S	*	*			trans	-163.2	162	-178.9	-91.1	-90.2	-15.2	0	0	105.5
45	P	42	Very low	34.2	Very low	107 Å²	107	139 Å²	139	70%	0.695	77%	0.773	S	S	*	*			cis	-137.6	162.9	26.1	41.3	-23.6	0	0	0	119.4
46	E	27	Very low	35.2	Very low	166 Å²	166	136.1 Å²	136.1	78%	0.776	76%	0.759	S	S	*	*			trans	60.8	163.8	147.7	-79.7	-158.6	118.3	0	0	122.5
47	P	41.7	Very low	36.8	Very low	117 Å²	117	134 Å²	134	76%	0.76	74%	0.741	S	S	*	*			cis	-117.5	-179.6	-15.3	23.6	-1.9	0	0	0	112.9
48	A	40.5	Very low	38.7	Very low	101 Å²	101	134.7 Å²	134.7	84%	0.835	73%	0.73	S	S	*	*			trans	-93.1	149.1	-171.3	0	0	0	0	0	115.3
49	A	31.2	Very low	40.5	Very low	103 Å²	103	129.1 Å²	129.1	85%	0.851	71%	0.706	S	S	*	*			trans	-133.7	122.9	158.5	0	0	0	0	0	109.9
50	K	41.1	Very low	42.9	Very low	199 Å²	199	120.7 Å²	120.7	87%	0.865	67%	0.671	S	S	*	*			trans	-104.7	116.9	171.8	-72.6	-179.8	178.9	176.1	0	109.3
51	S	36.5	Very low	45.3	Very low	117 Å²	117	119.1 Å²	119.1	82%	0.818	66%	0.655	S	S	*	*			trans	-90.8	98.2	167.8	42.6	0	0	0	0	110.6	E53	S51-E53 PolarHBondContact O-N 3.28Å; S51-E53 VanDerWaalsContact O-N 3.14Å
52	T	43.1	Very low	48	Very low	134 Å²	134	117 Å²	117	82%	0.822	64%	0.641	S	S	*	*			trans	-75.7	94.2	166.2	44	0	0	0	0	109.8
53	E	41.7	Very low	50.7	Low	109 Å²	109	110.3 Å²	110.3	51%	0.509	61%	0.61	S	S	.	*			trans	-60.1	140.7	171.2	-80.9	-161.7	114.6	0	0	112.4	S51 K58	S51-E53 PolarHBondContact O-N 3.28Å; S51-E53 VanDerWaalsContact O-N 3.14Å; E53-K58 WeakPolarHBondContact OE2-CE 2.93Å; E53-K58 IonicContact OE2-NZ 3.88Å
54	K	44.6	Very low	53.5	Low	157 Å²	157	106.3 Å²	106.3	68%	0.683	59%	0.587	S	S	*	*			trans	-69.7	148.4	171.6	-69	-179.9	178.7	177.7	0	110.6	A56 N57	K54-A56 PolarHBondContact O-N 3.28Å; K54-A56 VanDerWaalsContact O-N 3.14Å; K54-N57 PolarHBondContact O-N 3.23Å
55	P	53.3	Low	56.6	Low	115 Å²	115	104 Å²	104	75%	0.747	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-15.7	-179.8	25.9	-34.7	0	0	0	114.6
56	A	53.7	Low	58.8	Low	44 Å²	44	99.9 Å²	99.9	36%	0.364	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-47.9	176.1	0	0	0	0	0	112.7	K54 K58 K59 V60	K54-A56 PolarHBondContact O-N 3.28Å; K54-A56 VanDerWaalsContact O-N 3.14Å; A56-K58 PolarHBondContact O-N 3.14Å; A56-K58 VanDerWaalsContact O-N 3.09Å; A56-K59 WeakPolarHBondContact O-CB 3Å; A56-K59 PolarHBondContact O-N 2.87Å; A56-V60 PolarHBondContact O-N 2.92Å
57	N	60.2	Low	61.9	Low	84 Å²	84	94.2 Å²	94.2	45%	0.449	52%	0.521	S	S	.	.	H	α-helix	trans	-52	-39.2	-179.6	-68.8	31.7	0	0	0	112.3	K54 K59 V60 S61	K54-N57 PolarHBondContact O-N 3.23Å; N57-K59 VanDerWaalsContact C-N 3.29Å; N57-K59 PolarHBondContact O-N 3.29Å; N57-V60 PolarHBondContact O-N 2.81Å; N57-S61 PolarHBondContact O-N 3.45Å; N57-S61 PolarHBondContact O-OG 2.6Å
58	K	70.6	Confident	64.3	Low	124 Å²	124	94.3 Å²	94.3	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-73.6	-15.8	-177.5	-59.2	-169.4	177.6	-170.4	0	114.4	E53 A56 S61	E53-K58 WeakPolarHBondContact OE2-CE 2.93Å; E53-K58 IonicContact OE2-NZ 3.88Å; A56-K58 PolarHBondContact O-N 3.14Å; A56-K58 VanDerWaalsContact O-N 3.09Å; K58-S61 WeakPolarHBondContact CA-OG 3.16Å; K58-S61 PolarHBondContact O-OG 3.23Å
59	K	67.3	Low	66.9	Low	87 Å²	87	93.9 Å²	93.9	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-84.3	-44.3	167.7	-76.2	-172.4	169.3	-173.6	0	110.9	A56 N57 R62 L63 E112 Q180	A56-K59 WeakPolarHBondContact O-CB 3Å; A56-K59 PolarHBondContact O-N 2.87Å; N57-K59 VanDerWaalsContact C-N 3.29Å; N57-K59 PolarHBondContact O-N 3.29Å; K59-R62 PolarHBondContact O-N 2.89Å; K59-R62 VanDerWaalsContact O-N 3.15Å; K59-L63 PolarHBondContact O-N 2.69Å; K59-E112 IonicContact NZ-OE1 2.79Å; K59-E112 PolarHBondContact NZ-OE1 3.25Å; K59-E112 IonicContact NZ-OE2 3.62Å; K59-E112 PolarHBondContact NZ-OE2 3.16Å; K59-Q180 VanDerWaalsContact CD-OE1 3.26Å
60	V	75.7	Confident	69.9	Low	23 Å²	23	89 Å²	89	14%	0.139	45%	0.45	C	S	.	.	H	α-helix	trans	-58.2	-49.2	176.7	176.8	0	0	0	0	110.7	A56 N57 R62 L63 E64 I177	A56-V60 PolarHBondContact O-N 2.92Å; N57-V60 PolarHBondContact O-N 2.81Å; V60-R62 PolarHBondContact O-N 2.67Å; V60-R62 VanDerWaalsContact O-N 3.17Å; V60-L63 WeakPolarHBondContact O-CB 3.45Å; V60-L63 PolarHBondContact O-N 3.37Å; V60-L63 VanDerWaalsContact O-N 3.1Å; V60-E64 PolarHBondContact O-N 2.89Å; V60-I177 HydrophobicContact CG1-CD1 3.96Å; V60-I177 HydrophobicContact CG1-CG1 4.09Å; V60-I177 HydrophobicContact CG1-CG2 4.23Å; V60-I177 HydrophobicContact CG2-CG1 4.41Å; V60-I177 HydrophobicContact CG2-CG2 4.21Å
61	S	76.8	Confident	72.5	Confident	62 Å²	62	80.9 Å²	80.9	43%	0.434	42%	0.417	S	S	.	.	H	α-helix	trans	-59.3	-30.7	177.6	67	0	0	0	0	113.5	N57 K58 E65	N57-S61 PolarHBondContact O-N 3.45Å; N57-S61 PolarHBondContact O-OG 2.6Å; K58-S61 WeakPolarHBondContact CA-OG 3.16Å; K58-S61 PolarHBondContact O-OG 3.23Å; S61-E65 WeakPolarHBondContact O-CB 3.07Å; S61-E65 PolarHBondContact O-N 2.92Å
62	R	82.4	Confident	75.4	Confident	136 Å²	136	79 Å²	79	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-79.3	-34.2	177.4	-178.4	177.9	170.2	-176.4	-2.9	112.6	K59 V60 E64 E65 H66	K59-R62 PolarHBondContact O-N 2.89Å; K59-R62 VanDerWaalsContact O-N 3.15Å; V60-R62 PolarHBondContact O-N 2.67Å; V60-R62 VanDerWaalsContact O-N 3.17Å; R62-E64 VanDerWaalsContact C-N 3.34Å; R62-E65 PolarHBondContact O-N 3.01Å; R62-H66 PolarHBondContact NE-NE2 2.89Å; R62-H66 PolarHBondContact NH2-NE2 2.65Å; R62-H66 PolarHBondContact O-CD2 2.91Å; R62-H66 VanDerWaalsContact O-CD2 3.29Å; R62-H66 PolarHBondContact O-N 3.23Å
63	L	83.8	Confident	77.9	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-61.4	-45.1	170.2	-83.7	159.9	0	0	0	110.7	K59 V60 E65 H66 E67 L108 I111 V173 T176 I177	K59-L63 PolarHBondContact O-N 2.69Å; V60-L63 WeakPolarHBondContact O-CB 3.45Å; V60-L63 PolarHBondContact O-N 3.37Å; V60-L63 VanDerWaalsContact O-N 3.1Å; L63-E65 VanDerWaalsContact C-N 3.32Å; L63-E65 PolarHBondContact O-N 3.1Å; L63-H66 PolarHBondContact O-N 3.45Å; L63-E67 PolarHBondContact O-N 3.18Å; L63-L108 HydrophobicContact CD2-CD2 4.18Å; L63-I111 HydrophobicContact CD2-CD1 3.44Å; L63-I111 VanDerWaalsContact CD2-CD1 3.44Å; L63-I111 HydrophobicContact CG-CD1 4.16Å; L63-V173 HydrophobicContact CB-CG1 4.38Å; L63-T176 HydrophobicContact CD1-CG2 3.71Å; L63-T176 HydrophobicContact CD2-CG2 4.04Å; L63-I177 HydrophobicContact CD1-CG1 4.07Å
64	E	86.1	Confident	80.5	Confident	81 Å²	81	68.4 Å²	68.4	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-31.6	174	-61.6	179.3	-166.9	0	0	113.5	V60 R62 E67 K68	V60-E64 PolarHBondContact O-N 2.89Å; R62-E64 VanDerWaalsContact C-N 3.34Å; E64-E67 PolarHBondContact O-N 3.04Å; E64-K68 VanDerWaalsContact CB-NZ 3.33Å; E64-K68 WeakPolarHBondContact O-CD 3.28Å; E64-K68 VanDerWaalsContact O-CE 3.24Å; E64-K68 WeakPolarHBondContact O-CE 3.11Å; E64-K68 WeakPolarHBondContact O-CG 3.47Å; E64-K68 PolarHBondContact O-N 3.26Å; E64-K68 IonicContact OE2-NZ 3.89Å; E64-K68 PolarHBondContact OE2-NZ 3.15Å
65	E	89.2	Confident	82.9	Confident	115 Å²	115	67.4 Å²	67.4	54%	0.537	34%	0.343	S	S	.	.	H	α-helix	trans	-65.1	-49.9	175.2	-174.3	168.2	-140.2	0	0	110.7	S61 R62 L63 E67 K68 E69	S61-E65 WeakPolarHBondContact O-CB 3.07Å; S61-E65 PolarHBondContact O-N 2.92Å; R62-E65 PolarHBondContact O-N 3.01Å; L63-E65 VanDerWaalsContact C-N 3.32Å; L63-E65 PolarHBondContact O-N 3.1Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 3.06Å; E65-K68 WeakPolarHBondContact O-CA 3.43Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.47Å; E65-E69 PolarHBondContact O-N 3.31Å
66	H	87.8	Confident	84.8	Confident	19 Å²	19	67.5 Å²	67.5	9%	0.088	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-30.2	174.3	-65.9	-44	0	0	0	112.7	R62 L63 E69 V70 L108	R62-H66 PolarHBondContact NE-NE2 2.89Å; R62-H66 PolarHBondContact NH2-NE2 2.65Å; R62-H66 PolarHBondContact O-CD2 2.91Å; R62-H66 VanDerWaalsContact O-CD2 3.29Å; R62-H66 PolarHBondContact O-N 3.23Å; L63-H66 PolarHBondContact O-N 3.45Å; H66-E69 IonicContact CE1-OE2 2.83Å; H66-E69 IonicContact CG-OE2 2.75Å; H66-E69 IonicContact ND1-OE2 3.63Å; H66-E69 PolarHBondContact ND1-OE2 3.21Å; H66-E69 PolarHBondContact O-N 2.96Å; H66-V70 PolarHBondContact O-N 3.19Å; H66-V70 VanDerWaalsContact O-N 3.15Å; H66-L108 HydrophobicContact CB-CD2 3.43Å; H66-L108 VanDerWaalsContact CB-CD2 3.43Å; H66-L108 HydrophobicContact CB-CG 3.77Å
67	E	92.2	Very high	86.8	Confident	47 Å²	47	65.4 Å²	65.4	22%	0.22	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-45.7	168.4	-161.7	-158.6	138.2	0	0	111.2	L63 E64 E65 E69 V70 V71 V169 V173	L63-E67 PolarHBondContact O-N 3.18Å; E64-E67 PolarHBondContact O-N 3.04Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 3.06Å; E67-E69 VanDerWaalsContact C-N 3.28Å; E67-E69 PolarHBondContact O-N 3.22Å; E67-V70 PolarHBondContact O-N 3.44Å; E67-V71 HydrophobicContact CG-CG2 4.43Å; E67-V71 WeakPolarHBondContact O-CB 3.08Å; E67-V71 VanDerWaalsContact O-CG2 3.26Å; E67-V71 WeakPolarHBondContact O-CG2 3.4Å; E67-V71 PolarHBondContact O-N 3.2Å; E67-V169 HydrophobicContact CG-CG1 4.22Å; E67-V173 HydrophobicContact CB-CG2 4.18Å; E67-V173 HydrophobicContact CG-CG2 4.29Å
68	K	93.2	Very high	88.3	Confident	120 Å²	120	65 Å²	65	52%	0.522	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-34.4	179	-67.2	152.1	-160.1	156.5	0	111.4	E64 E65 S72	E64-K68 VanDerWaalsContact CB-NZ 3.33Å; E64-K68 WeakPolarHBondContact O-CD 3.28Å; E64-K68 VanDerWaalsContact O-CE 3.24Å; E64-K68 WeakPolarHBondContact O-CE 3.11Å; E64-K68 WeakPolarHBondContact O-CG 3.47Å; E64-K68 PolarHBondContact O-N 3.26Å; E64-K68 IonicContact OE2-NZ 3.89Å; E64-K68 PolarHBondContact OE2-NZ 3.15Å; E65-K68 WeakPolarHBondContact O-CA 3.43Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.47Å; K68-S72 WeakPolarHBondContact O-CB 3.42Å; K68-S72 PolarHBondContact O-N 2.82Å
69	E	94.4	Very high	89.3	Confident	92 Å²	92	62.6 Å²	62.6	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-49.5	172	-67.7	179.1	138.8	0	0	112	E65 H66 E67 V71 S72 A73 A104	E65-E69 PolarHBondContact O-N 3.31Å; H66-E69 IonicContact CE1-OE2 2.83Å; H66-E69 IonicContact CG-OE2 2.75Å; H66-E69 IonicContact ND1-OE2 3.63Å; H66-E69 PolarHBondContact ND1-OE2 3.21Å; H66-E69 PolarHBondContact O-N 2.96Å; E67-E69 VanDerWaalsContact C-N 3.28Å; E67-E69 PolarHBondContact O-N 3.22Å; E69-V71 PolarHBondContact O-N 2.9Å; E69-S72 WeakPolarHBondContact O-CB 3.19Å; E69-S72 PolarHBondContact O-N 2.75Å; E69-S72 VanDerWaalsContact O-N 3.15Å; E69-A73 PolarHBondContact O-N 2.91Å; E69-A104 HydrophobicContact CB-CB 4.5Å
70	V	94.8	Very high	90.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-42.6	176.4	177	0	0	0	0	111.7	H66 E67 S72 A73 L74 A104 I105 L108 V169	H66-V70 PolarHBondContact O-N 3.19Å; H66-V70 VanDerWaalsContact O-N 3.15Å; E67-V70 PolarHBondContact O-N 3.44Å; V70-S72 PolarHBondContact O-N 2.74Å; V70-A73 PolarHBondContact O-N 3.25Å; V70-L74 HydrophobicContact CG1-CD1 3.79Å; V70-L74 HydrophobicContact CG1-CG 4.22Å; V70-L74 WeakPolarHBondContact O-CB 3.34Å; V70-L74 WeakPolarHBondContact O-CG 3.22Å; V70-L74 PolarHBondContact O-N 3.46Å; V70-A104 HydrophobicContact CB-CB 4.46Å; V70-A104 VanDerWaalsContact CG2-C 3.46Å; V70-A104 HydrophobicContact CG2-CB 3.79Å; V70-A104 VanDerWaalsContact CG2-O 3.22Å; V70-A104 WeakPolarHBondContact CG2-O 3.49Å; V70-I105 HydrophobicContact CB-CG1 4.43Å; V70-I105 HydrophobicContact CG1-CD1 4.22Å; V70-I105 HydrophobicContact CG1-CG1 3.84Å; V70-I105 HydrophobicContact CG2-CB 4.47Å; V70-I105 HydrophobicContact CG2-CG1 3.62Å; V70-L108 HydrophobicContact CG2-CD1 3.75Å; V70-V169 HydrophobicContact CB-CG1 4.39Å; V70-V169 HydrophobicContact CG1-CG1 4.22Å; V70-V169 HydrophobicContact CG1-CG2 4.28Å
71	V	95.4	Very high	90.9	Very high	29 Å²	29	57.6 Å²	57.6	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-37.6	174.6	168.8	0	0	0	0	111.1	E67 E69 K75 L166	E67-V71 HydrophobicContact CG-CG2 4.43Å; E67-V71 WeakPolarHBondContact O-CB 3.08Å; E67-V71 VanDerWaalsContact O-CG2 3.26Å; E67-V71 WeakPolarHBondContact O-CG2 3.4Å; E67-V71 PolarHBondContact O-N 3.2Å; E69-V71 PolarHBondContact O-N 2.9Å; V71-K75 HydrophobicContact CG1-CD 4.05Å; V71-K75 WeakPolarHBondContact O-CB 3.48Å; V71-K75 WeakPolarHBondContact O-CD 3.07Å; V71-K75 WeakPolarHBondContact O-CG 3.47Å; V71-K75 PolarHBondContact O-N 3.38Å; V71-L166 HydrophobicContact CG2-CD1 3.71Å
72	S	96.4	Very high	91.4	Very high	76 Å²	76	58.6 Å²	58.6	53%	0.531	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-48.4	175.5	-164.4	0	0	0	0	111.7	K68 E69 V70 L74 K75 Y76	K68-S72 WeakPolarHBondContact O-CB 3.42Å; K68-S72 PolarHBondContact O-N 2.82Å; E69-S72 WeakPolarHBondContact O-CB 3.19Å; E69-S72 PolarHBondContact O-N 2.75Å; E69-S72 VanDerWaalsContact O-N 3.15Å; V70-S72 PolarHBondContact O-N 2.74Å; S72-L74 PolarHBondContact O-N 3.21Å; S72-K75 PolarHBondContact O-N 3.13Å; S72-Y76 PolarHBondContact O-N 3.22Å
73	A	96.8	Very high	91.5	Very high	15 Å²	15	56.2 Å²	56.2	12%	0.124	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-43.8	177.9	0	0	0	0	0	112.3	E69 V70 Y76 F77 V101 A104	E69-A73 PolarHBondContact O-N 2.91Å; V70-A73 PolarHBondContact O-N 3.25Å; A73-Y76 PolarHBondContact O-N 3.14Å; A73-F77 WeakPolarHBondContact O-CB 3.47Å; A73-F77 PolarHBondContact O-N 3.41Å; A73-V101 HydrophobicContact CB-CG2 3.88Å; A73-A104 HydrophobicContact CB-CB 4.14Å
74	L	96	Very high	91.3	Very high	6 Å²	6	56 Å²	56	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-67.5	-35.1	176	-71.7	173	0	0	0	112.7	V70 S72 K78 V101 L135 I162 V165 L166	V70-L74 HydrophobicContact CG1-CD1 3.79Å; V70-L74 HydrophobicContact CG1-CG 4.22Å; V70-L74 WeakPolarHBondContact O-CB 3.34Å; V70-L74 WeakPolarHBondContact O-CG 3.22Å; V70-L74 PolarHBondContact O-N 3.46Å; S72-L74 PolarHBondContact O-N 3.21Å; L74-K78 WeakPolarHBondContact O-CB 3.33Å; L74-K78 PolarHBondContact O-N 2.94Å; L74-V101 HydrophobicContact CD2-CG1 3.71Å; L74-V101 HydrophobicContact CD2-CG2 3.97Å; L74-V101 HydrophobicContact CG-CG1 4.19Å; L74-V101 HydrophobicContact CG-CG2 4.4Å; L74-L135 HydrophobicContact CD2-CD2 3.92Å; L74-I162 HydrophobicContact CD2-CG2 4.42Å; L74-V165 HydrophobicContact CD1-CB 4.33Å; L74-V165 HydrophobicContact CD1-CG1 4.01Å; L74-V165 HydrophobicContact CD2-CB 4.36Å; L74-V165 HydrophobicContact CD2-CG1 4.21Å; L74-L166 HydrophobicContact CD1-CB 3.95Å; L74-L166 HydrophobicContact CD1-CD1 4.36Å
75	K	94.5	Very high	90.4	Very high	136 Å²	136	56.6 Å²	56.6	59%	0.591	28%	0.281	S	S	*	.	H	α-helix	trans	-64.6	-41.6	171.7	-79.5	168.6	-179.7	174.7	0	111.6	V71 S72 K78 T79	V71-K75 HydrophobicContact CG1-CD 4.05Å; V71-K75 WeakPolarHBondContact O-CB 3.48Å; V71-K75 WeakPolarHBondContact O-CD 3.07Å; V71-K75 WeakPolarHBondContact O-CG 3.47Å; V71-K75 PolarHBondContact O-N 3.38Å; S72-K75 PolarHBondContact O-N 3.13Å; K75-K78 PolarHBondContact O-N 2.74Å; K75-T79 WeakPolarHBondContact O-CB 3.42Å; K75-T79 PolarHBondContact O-N 3.18Å; K75-T79 PolarHBondContact O-OG1 3.31Å
76	Y	94.4	Very high	89.4	Confident	118 Å²	118	56.9 Å²	56.9	46%	0.463	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-48.8	176.7	-176.5	-111.1	0	0	0	111.2	S72 A73 K78 T79 I80	S72-Y76 PolarHBondContact O-N 3.22Å; A73-Y76 PolarHBondContact O-N 3.14Å; Y76-K78 PolarHBondContact O-N 3.09Å; Y76-T79 WeakPolarHBondContact O-CB 3.34Å; Y76-T79 PolarHBondContact O-N 3.39Å; Y76-T79 VanDerWaalsContact O-N 3.07Å; Y76-I80 HydrophobicContact CD1-CD1 3.89Å; Y76-I80 HydrophobicContact CE1-CD1 3.46Å; Y76-I80 VanDerWaalsContact CE1-CD1 3.46Å; Y76-I80 HydrophobicContact CE1-CG1 4.46Å; Y76-I80 HydrophobicContact CE2-CD1 4.44Å; Y76-I80 WeakPolarHBondContact O-CG1 3.48Å; Y76-I80 PolarHBondContact O-N 3.12Å
77	F	94.3	Very high	88.9	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-54.5	-48.6	172.9	-172	-81.8	0	0	0	111.8	A73 T79 I80 V81 L94 S97 A98 V101 L135 W138 A139 V158 I162	A73-F77 WeakPolarHBondContact O-CB 3.47Å; A73-F77 PolarHBondContact O-N 3.41Å; F77-T79 VanDerWaalsContact C-N 3.31Å; F77-T79 PolarHBondContact O-N 3.09Å; F77-I80 WeakPolarHBondContact O-CB 3.5Å; F77-I80 PolarHBondContact O-N 2.93Å; F77-V81 HydrophobicContact CD1-CG2 3.91Å; F77-V81 HydrophobicContact CE1-CG2 3.58Å; F77-V81 HydrophobicContact CZ-CG2 4.36Å; F77-V81 WeakPolarHBondContact O-CG2 3.49Å; F77-V81 PolarHBondContact O-N 3.32Å; F77-L94 HydrophobicContact CD2-CD2 4.44Å; F77-L94 HydrophobicContact CE1-CD2 4.35Å; F77-L94 HydrophobicContact CE2-CD2 3.94Å; F77-L94 HydrophobicContact CZ-CD2 3.91Å; F77-S97 WeakPolarHBondContact CD2-OG 3.43Å; F77-A98 HydrophobicContact CD2-CB 4.45Å; F77-A98 HydrophobicContact CE2-CB 3.97Å; F77-V101 HydrophobicContact CB-CG2 4.34Å; F77-L135 HydrophobicContact CD1-CD1 4.06Å; F77-L135 HydrophobicContact CE1-CD1 3.56Å; F77-L135 HydrophobicContact CE1-CG 4.34Å; F77-L135 HydrophobicContact CE2-CG 4.47Å; F77-L135 HydrophobicContact CZ-CD1 3.83Å; F77-L135 HydrophobicContact CZ-CG 4.18Å; F77-W138 HydrophobicContact CE1-CE3 4.46Å; F77-W138 HydrophobicContact CE1-CZ3 4.21Å; F77-W138 AromaticContact CZ-CE3 3.93Å; F77-W138 HydrophobicContact CZ-CE3 3.93Å; F77-W138 AromaticContact CZ-CZ3 3.81Å; F77-W138 HydrophobicContact CZ-CZ3 3.81Å; F77-A139 HydrophobicContact CE2-CB 4.1Å; F77-A139 HydrophobicContact CZ-CB 4.26Å; F77-V158 HydrophobicContact CE1-CG2 3.92Å; F77-V158 HydrophobicContact CZ-CG2 4.49Å; F77-I162 HydrophobicContact CD1-CD1 3.71Å; F77-I162 HydrophobicContact CD1-CG1 3.94Å; F77-I162 HydrophobicContact CE1-CD1 3.95Å; F77-I162 HydrophobicContact CE1-CG1 4.14Å
78	K	92.2	Very high	87.9	Confident	76 Å²	76	65.4 Å²	65.4	33%	0.33	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-37.2	176.3	-162.9	-160.9	-179.4	-60.4	0	112.3	L74 K75 Y76 I80 V81 D82 I162	L74-K78 WeakPolarHBondContact O-CB 3.33Å; L74-K78 PolarHBondContact O-N 2.94Å; K75-K78 PolarHBondContact O-N 2.74Å; Y76-K78 PolarHBondContact O-N 3.09Å; K78-I80 VanDerWaalsContact C-N 3.29Å; K78-I80 PolarHBondContact O-N 2.96Å; K78-V81 WeakPolarHBondContact O-CB 3.47Å; K78-V81 PolarHBondContact O-N 3.11Å; K78-D82 IonicContact NZ-OD1 3.41Å; K78-D82 PolarHBondContact NZ-OD1 3.22Å; K78-D82 IonicContact NZ-OD2 2.63Å; K78-D82 PolarHBondContact NZ-OD2 2.61Å; K78-D82 WeakPolarHBondContact O-CB 3.25Å; K78-D82 PolarHBondContact O-N 2.9Å; K78-I162 HydrophobicContact CB-CD1 4.21Å; K78-I162 HydrophobicContact CG-CD1 4.21Å
79	T	91.3	Very high	87	Confident	73 Å²	73	67.8 Å²	67.8	45%	0.448	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-34.9	177.4	-55.3	0	0	0	0	111.7	K75 Y76 F77 K83	K75-T79 WeakPolarHBondContact O-CB 3.42Å; K75-T79 PolarHBondContact O-N 3.18Å; K75-T79 PolarHBondContact O-OG1 3.31Å; Y76-T79 WeakPolarHBondContact O-CB 3.34Å; Y76-T79 PolarHBondContact O-N 3.39Å; Y76-T79 VanDerWaalsContact O-N 3.07Å; F77-T79 VanDerWaalsContact C-N 3.31Å; F77-T79 PolarHBondContact O-N 3.09Å; T79-K83 HydrophobicContact CG2-CD 4.49Å; T79-K83 WeakPolarHBondContact O-CB 3.34Å; T79-K83 WeakPolarHBondContact O-CG 3.36Å; T79-K83 PolarHBondContact O-N 3.41Å
80	I	89.5	Confident	86.3	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-45.7	172.6	-65.5	170.6	0	0	0	110.2	Y76 F77 K78 K83 M84 V90 M93 L94	Y76-I80 HydrophobicContact CD1-CD1 3.89Å; Y76-I80 HydrophobicContact CE1-CD1 3.46Å; Y76-I80 VanDerWaalsContact CE1-CD1 3.46Å; Y76-I80 HydrophobicContact CE1-CG1 4.46Å; Y76-I80 HydrophobicContact CE2-CD1 4.44Å; Y76-I80 WeakPolarHBondContact O-CG1 3.48Å; Y76-I80 PolarHBondContact O-N 3.12Å; F77-I80 WeakPolarHBondContact O-CB 3.5Å; F77-I80 PolarHBondContact O-N 2.93Å; K78-I80 VanDerWaalsContact C-N 3.29Å; K78-I80 PolarHBondContact O-N 2.96Å; I80-K83 PolarHBondContact O-N 2.93Å; I80-M84 PolarHBondContact O-N 3.39Å; I80-M84 VanDerWaalsContact O-N 3.11Å; I80-V90 HydrophobicContact CB-CG1 4.03Å; I80-V90 HydrophobicContact CG1-CG1 4.31Å; I80-V90 HydrophobicContact CG2-CG1 3.52Å; I80-V90 VanDerWaalsContact CG2-O 3.31Å; I80-V90 WeakPolarHBondContact CG2-O 3.34Å; I80-V90 WeakPolarHBondContact O-CG1 3.4Å; I80-M93 HydrophobicContact CD1-CB 3.84Å; I80-M93 HydrophobicContact CG1-CE 4.32Å; I80-M93 HydrophobicContact CG2-CB 4.48Å; I80-L94 HydrophobicContact CB-CD2 4.05Å; I80-L94 HydrophobicContact CG2-CD2 3.35Å; I80-L94 HydrophobicContact CG2-CG 3.53Å
81	V	87.3	Confident	85.4	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.8	-50.8	174.4	166.1	0	0	0	0	111.7	F77 K78 K83 M84 L94 W138 V158 I162	F77-V81 HydrophobicContact CD1-CG2 3.91Å; F77-V81 HydrophobicContact CE1-CG2 3.58Å; F77-V81 HydrophobicContact CZ-CG2 4.36Å; F77-V81 WeakPolarHBondContact O-CG2 3.49Å; F77-V81 PolarHBondContact O-N 3.32Å; K78-V81 WeakPolarHBondContact O-CB 3.47Å; K78-V81 PolarHBondContact O-N 3.11Å; V81-K83 PolarHBondContact O-N 2.92Å; V81-M84 HydrophobicContact CB-CE 3.95Å; V81-M84 HydrophobicContact CG1-CE 3.66Å; V81-M84 HydrophobicContact CG2-CE 4.09Å; V81-M84 WeakPolarHBondContact O-CB 3.49Å; V81-M84 WeakPolarHBondContact O-CE 3.43Å; V81-M84 VanDerWaalsContact O-CG 3.3Å; V81-M84 WeakPolarHBondContact O-CG 3.32Å; V81-M84 PolarHBondContact O-N 3.41Å; V81-M84 VanDerWaalsContact O-N 3.11Å; V81-L94 HydrophobicContact CG2-CD2 3.89Å; V81-W138 HydrophobicContact CG2-CH2 4.08Å; V81-W138 HydrophobicContact CG2-CZ3 4.14Å; V81-V158 HydrophobicContact CG1-CG1 3.84Å; V81-V158 HydrophobicContact CG2-CG1 4.41Å; V81-V158 HydrophobicContact CG2-CG2 4.47Å; V81-I162 HydrophobicContact CG2-CD1 4.42Å
82	D	86.6	Confident	84.7	Confident	83 Å²	83	69.7 Å²	69.7	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-61.1	-31.2	-179.5	-67.7	-17.5	0	0	0	112.4	K78	K78-D82 IonicContact NZ-OD1 3.41Å; K78-D82 PolarHBondContact NZ-OD1 3.22Å; K78-D82 IonicContact NZ-OD2 2.63Å; K78-D82 PolarHBondContact NZ-OD2 2.61Å; K78-D82 WeakPolarHBondContact O-CB 3.25Å; K78-D82 PolarHBondContact O-N 2.9Å
83	K	84.5	Confident	84.2	Confident	87 Å²	87	70 Å²	70	38%	0.378	34%	0.34	S	S	.	.	H	α-helix	trans	-83.7	-16.3	177.5	-84.2	177.9	153.4	-105	0	114.6	T79 I80 V81 V85 V86 E87 V90	T79-K83 HydrophobicContact CG2-CD 4.49Å; T79-K83 WeakPolarHBondContact O-CB 3.34Å; T79-K83 WeakPolarHBondContact O-CG 3.36Å; T79-K83 PolarHBondContact O-N 3.41Å; I80-K83 PolarHBondContact O-N 2.93Å; V81-K83 PolarHBondContact O-N 2.92Å; K83-V85 PolarHBondContact O-N 3.41Å; K83-V85 VanDerWaalsContact O-N 3.11Å; K83-V86 PolarHBondContact O-N 3.08Å; K83-E87 IonicContact NZ-OE1 2.75Å; K83-E87 PolarHBondContact NZ-OE1 3.08Å; K83-E87 IonicContact NZ-OE2 3.74Å; K83-E87 PolarHBondContact O-N 3.39Å; K83-V90 HydrophobicContact CB-CB 4.49Å; K83-V90 HydrophobicContact CB-CG1 3.92Å; K83-V90 HydrophobicContact CB-CG2 4.47Å
84	M	80	Confident	83.9	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.1	-172.8	86.3	172.5	74.5	0	0	113.1	I80 V81 V86 L91 W138 I147 L149 V155	I80-M84 PolarHBondContact O-N 3.39Å; I80-M84 VanDerWaalsContact O-N 3.11Å; V81-M84 HydrophobicContact CB-CE 3.95Å; V81-M84 HydrophobicContact CG1-CE 3.66Å; V81-M84 HydrophobicContact CG2-CE 4.09Å; V81-M84 WeakPolarHBondContact O-CB 3.49Å; V81-M84 WeakPolarHBondContact O-CE 3.43Å; V81-M84 VanDerWaalsContact O-CG 3.3Å; V81-M84 WeakPolarHBondContact O-CG 3.32Å; V81-M84 PolarHBondContact O-N 3.41Å; V81-M84 VanDerWaalsContact O-N 3.11Å; M84-V86 PolarHBondContact O-N 2.8Å; M84-L91 HydrophobicContact CB-CD2 3.67Å; M84-L91 HydrophobicContact CB-CG 4.35Å; M84-L91 HydrophobicContact CG-CD2 4.41Å; M84-L91 HydrophobicContact SD-CD2 4.18Å; M84-W138 HydrophobicContact CE-CH2 3.67Å; M84-W138 HydrophobicContact CE-CZ2 4.06Å; M84-I147 HydrophobicContact CE-CD1 4.07Å; M84-I147 HydrophobicContact SD-CD1 3.37Å; M84-I147 WeakPolarHBondContact SD-CD1 3.41Å; M84-I147 HydrophobicContact SD-CG2 4.45Å; M84-L149 HydrophobicContact CG-CD2 4.17Å; M84-L149 HydrophobicContact SD-CD2 4.42Å; M84-V155 HydrophobicContact SD-CG2 4.31Å
85	V	66.9	Low	83.6	Confident	93 Å²	93	69.2 Å²	69.2	56%	0.564	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.9	-178	-172.8	0	0	0	0	111.8	K83	K83-V85 PolarHBondContact O-N 3.41Å; K83-V85 VanDerWaalsContact O-N 3.11Å
86	V	70	Confident	83.5	Confident	121 Å²	121	64.5 Å²	64.5	73%	0.733	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-39.2	-176.8	-172.1	0	0	0	0	111.8	K83 M84	K83-V86 PolarHBondContact O-N 3.08Å; M84-V86 PolarHBondContact O-N 2.8Å
87	E	77.1	Confident	83.5	Confident	85 Å²	85	59.1 Å²	59.1	40%	0.397	30%	0.303	S	S	.	.			trans	-126.6	93.4	-171.5	-66.2	172.4	-137.3	0	0	110.9	K83 K89 V90	K83-E87 IonicContact NZ-OE1 2.75Å; K83-E87 PolarHBondContact NZ-OE1 3.08Å; K83-E87 IonicContact NZ-OE2 3.74Å; K83-E87 PolarHBondContact O-N 3.39Å; E87-K89 PolarHBondContact O-N 3.16Å; E87-V90 HydrophobicContact CB-CB 4.22Å; E87-V90 HydrophobicContact CB-CG2 3.58Å; E87-V90 HydrophobicContact CG-CG2 4.46Å; E87-V90 VanDerWaalsContact O-CB 3.29Å; E87-V90 WeakPolarHBondContact O-CB 3.45Å; E87-V90 PolarHBondContact O-N 3.06Å; E87-V90 VanDerWaalsContact OE2-CG2 3.3Å; E87-V90 WeakPolarHBondContact OE2-CG2 3.44Å
88	K	71.2	Confident	83.6	Confident	160 Å²	160	59.1 Å²	59.1	70%	0.696	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-55.6	-29	-178.5	-168.7	171.2	-177.3	169.4	0	114	V90 L91	K88-V90 PolarHBondContact O-N 3.18Å; K88-L91 HydrophobicContact CG-CD1 3.97Å; K88-L91 WeakPolarHBondContact O-CB 3.08Å; K88-L91 WeakPolarHBondContact O-CG 3.3Å; K88-L91 PolarHBondContact O-N 2.85Å
89	K	73.1	Confident	83.7	Confident	169 Å²	169	56.4 Å²	56.4	74%	0.735	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-64.2	-25.1	174.1	-68.7	-167.4	173.8	-167.8	0	113.8	E87 L91 E92	E87-K89 PolarHBondContact O-N 3.16Å; K89-L91 PolarHBondContact O-N 3.34Å; K89-E92 WeakPolarHBondContact O-CB 3.39Å; K89-E92 PolarHBondContact O-N 3.16Å
90	V	79.3	Confident	84	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.055	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-67.6	-24.6	179.7	171.1	0	0	0	0	111.6	I80 K83 E87 K88 E92 M93	I80-V90 HydrophobicContact CB-CG1 4.03Å; I80-V90 HydrophobicContact CG1-CG1 4.31Å; I80-V90 HydrophobicContact CG2-CG1 3.52Å; I80-V90 VanDerWaalsContact CG2-O 3.31Å; I80-V90 WeakPolarHBondContact CG2-O 3.34Å; I80-V90 WeakPolarHBondContact O-CG1 3.4Å; K83-V90 HydrophobicContact CB-CB 4.49Å; K83-V90 HydrophobicContact CB-CG1 3.92Å; K83-V90 HydrophobicContact CB-CG2 4.47Å; E87-V90 HydrophobicContact CB-CB 4.22Å; E87-V90 HydrophobicContact CB-CG2 3.58Å; E87-V90 HydrophobicContact CG-CG2 4.46Å; E87-V90 VanDerWaalsContact O-CB 3.29Å; E87-V90 WeakPolarHBondContact O-CB 3.45Å; E87-V90 PolarHBondContact O-N 3.06Å; E87-V90 VanDerWaalsContact OE2-CG2 3.3Å; E87-V90 WeakPolarHBondContact OE2-CG2 3.44Å; K88-V90 PolarHBondContact O-N 3.18Å; V90-E92 PolarHBondContact O-N 2.95Å; V90-M93 HydrophobicContact CB-CE 4.27Å; V90-M93 HydrophobicContact CG1-CE 3.91Å; V90-M93 HydrophobicContact CG2-CE 4.13Å; V90-M93 PolarHBondContact O-N 3.34Å; V90-M93 VanDerWaalsContact O-N 3.14Å
91	L	75.9	Confident	84.3	Confident	19 Å²	19	58.4 Å²	58.4	10%	0.099	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-56.2	-33	172.3	-66.6	173.4	0	0	0	113	M84 K88 K89 M93 L94 V142 I147	M84-L91 HydrophobicContact CB-CD2 3.67Å; M84-L91 HydrophobicContact CB-CG 4.35Å; M84-L91 HydrophobicContact CG-CD2 4.41Å; M84-L91 HydrophobicContact SD-CD2 4.18Å; K88-L91 HydrophobicContact CG-CD1 3.97Å; K88-L91 WeakPolarHBondContact O-CB 3.08Å; K88-L91 WeakPolarHBondContact O-CG 3.3Å; K88-L91 PolarHBondContact O-N 2.85Å; K89-L91 PolarHBondContact O-N 3.34Å; L91-M93 PolarHBondContact O-N 3.31Å; L91-M93 VanDerWaalsContact O-N 3.15Å; L91-L94 HydrophobicContact CD2-CD1 3.66Å; L91-L94 WeakPolarHBondContact O-CB 3.43Å; L91-L94 PolarHBondContact O-N 3.24Å; L91-V142 HydrophobicContact CD2-CG1 3.97Å; L91-I147 HydrophobicContact CD2-CD1 3.87Å
92	E	80.6	Confident	84.7	Confident	133 Å²	133	58.5 Å²	58.5	62%	0.621	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-63.8	-22.1	-178.1	-60.3	178.5	157	0	0	112.3	K89 V90	K89-E92 WeakPolarHBondContact O-CB 3.39Å; K89-E92 PolarHBondContact O-N 3.16Å; V90-E92 PolarHBondContact O-N 2.95Å
93	M	87.6	Confident	85.1	Confident	83 Å²	83	57.8 Å²	57.8	41%	0.409	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-85	-13.5	176.3	-61	-169.9	-69.8	0	0	114.1	I80 V90 L91 S97	I80-M93 HydrophobicContact CD1-CB 3.84Å; I80-M93 HydrophobicContact CG1-CE 4.32Å; I80-M93 HydrophobicContact CG2-CB 4.48Å; V90-M93 HydrophobicContact CB-CE 4.27Å; V90-M93 HydrophobicContact CG1-CE 3.91Å; V90-M93 HydrophobicContact CG2-CE 4.13Å; V90-M93 PolarHBondContact O-N 3.34Å; V90-M93 VanDerWaalsContact O-N 3.14Å; L91-M93 PolarHBondContact O-N 3.31Å; L91-M93 VanDerWaalsContact O-N 3.15Å; M93-S97 WeakPolarHBondContact O-CB 3.22Å; M93-S97 PolarHBondContact O-N 2.67Å; M93-S97 PolarHBondContact O-OG 2.84Å
94	L	89.6	Confident	85.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.8	-49.1	-176.5	-77.5	170.5	0	0	0	113.4	F77 I80 V81 L91 G96 S97 A98 W138 V142	F77-L94 HydrophobicContact CD2-CD2 4.44Å; F77-L94 HydrophobicContact CE1-CD2 4.35Å; F77-L94 HydrophobicContact CE2-CD2 3.94Å; F77-L94 HydrophobicContact CZ-CD2 3.91Å; I80-L94 HydrophobicContact CB-CD2 4.05Å; I80-L94 HydrophobicContact CG2-CD2 3.35Å; I80-L94 HydrophobicContact CG2-CG 3.53Å; V81-L94 HydrophobicContact CG2-CD2 3.89Å; L91-L94 HydrophobicContact CD2-CD1 3.66Å; L91-L94 WeakPolarHBondContact O-CB 3.43Å; L91-L94 PolarHBondContact O-N 3.24Å; L94-G96 PolarHBondContact O-N 3.31Å; L94-S97 WeakPolarHBondContact CA-OG 3.4Å; L94-S97 PolarHBondContact O-N 3.34Å; L94-S97 VanDerWaalsContact O-N 3.14Å; L94-S97 PolarHBondContact O-OG 2.85Å; L94-A98 PolarHBondContact O-N 2.74Å; L94-W138 HydrophobicContact CD1-CH2 3.86Å; L94-W138 HydrophobicContact CD1-CZ3 3.8Å; L94-W138 HydrophobicContact CD2-CZ3 4.05Å; L94-W138 HydrophobicContact CG-CZ3 4.49Å; L94-V142 HydrophobicContact CD1-CG1 3.62Å
95	P	90.5	Very high	86.3	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.032	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-38.1	-174	-22.5	36	0	0	0	112.7	S99 M143 R908 L912	P95-S99 PolarHBondContact O-N 3.45Å; P95-S99 VanDerWaalsContact O-N 3.16Å; P95-S99 PolarHBondContact O-OG 3.02Å; P95-S99 VanDerWaalsContact O-OG 3.1Å; P95-M143 HydrophobicContact CB-SD 3.96Å; P95-M143 HydrophobicContact CG-CB 3.74Å; P95-M143 HydrophobicContact CG-CG 3.94Å; P95-M143 HydrophobicContact CG-SD 3.58Å; P95-M143 VanDerWaalsContact CG-SD 3.58Å; P95-R908 PolarHBondContact O-NH2 3.37Å; P95-L912 HydrophobicContact CB-CD1 4.46Å; P95-L912 HydrophobicContact CB-CD2 3.6Å
96	G	91.9	Very high	87.4	Confident	37 Å²	37	51.2 Å²	51.2	38%	0.381	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-37.1	173.5	0	0	0	0	0	112.8	L94 S99 K100	L94-G96 PolarHBondContact O-N 3.31Å; G96-S99 WeakPolarHBondContact O-CB 3.45Å; G96-S99 PolarHBondContact O-N 3.29Å; G96-K100 PolarHBondContact O-N 3.27Å
97	S	94.3	Very high	88.2	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-68.8	-34	174.6	72.2	0	0	0	0	112.7	F77 M93 L94 S99 K100 V101	F77-S97 WeakPolarHBondContact CD2-OG 3.43Å; M93-S97 WeakPolarHBondContact O-CB 3.22Å; M93-S97 PolarHBondContact O-N 2.67Å; M93-S97 PolarHBondContact O-OG 2.84Å; L94-S97 WeakPolarHBondContact CA-OG 3.4Å; L94-S97 PolarHBondContact O-N 3.34Å; L94-S97 VanDerWaalsContact O-N 3.14Å; L94-S97 PolarHBondContact O-OG 2.85Å; S97-S99 VanDerWaalsContact C-N 3.34Å; S97-K100 PolarHBondContact O-N 3.11Å; S97-K100 VanDerWaalsContact O-N 3.15Å; S97-V101 PolarHBondContact O-N 2.83Å; S97-V101 VanDerWaalsContact O-N 3.12Å
98	A	95.4	Very high	88.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-41	169.5	0	0	0	0	0	111.7	F77 L94 K100 V101 L102 I136 A139	F77-A98 HydrophobicContact CD2-CB 4.45Å; F77-A98 HydrophobicContact CE2-CB 3.97Å; L94-A98 PolarHBondContact O-N 2.74Å; A98-K100 VanDerWaalsContact C-N 3.27Å; A98-K100 PolarHBondContact O-N 2.89Å; A98-V101 PolarHBondContact O-N 3.32Å; A98-V101 VanDerWaalsContact O-N 3.14Å; A98-L102 PolarHBondContact O-N 3.44Å; A98-I136 HydrophobicContact CB-CG1 4.28Å; A98-A139 HydrophobicContact CB-CB 3.74Å
99	S	95.9	Very high	88.8	Confident	19 Å²	19	36.7 Å²	36.7	13%	0.133	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-35	172.6	-55.9	0	0	0	0	112.4	P95 G96 S97 L102 E103 R908 L912	P95-S99 PolarHBondContact O-N 3.45Å; P95-S99 VanDerWaalsContact O-N 3.16Å; P95-S99 PolarHBondContact O-OG 3.02Å; P95-S99 VanDerWaalsContact O-OG 3.1Å; G96-S99 WeakPolarHBondContact O-CB 3.45Å; G96-S99 PolarHBondContact O-N 3.29Å; S97-S99 VanDerWaalsContact C-N 3.34Å; S99-L102 WeakPolarHBondContact O-CB 3.43Å; S99-L102 PolarHBondContact O-N 2.74Å; S99-E103 WeakPolarHBondContact O-CG 3.47Å; S99-E103 PolarHBondContact O-N 3.02Å; S99-R908 WeakPolarHBondContact OG-CD 3.11Å; S99-R908 PolarHBondContact OG-NE 2.97Å; S99-L912 VanDerWaalsContact OG-CD1 3.23Å; S99-L912 WeakPolarHBondContact OG-CD1 3.3Å
100	K	96.1	Very high	88.9	Confident	120 Å²	120	34.5 Å²	34.5	52%	0.522	18%	0.182	S	C	.	.	H	α-helix	trans	-70.2	-31.6	174.5	-67	-69.3	160.6	-158.5	0	113.4	G96 S97 A98 E103 A104	G96-K100 PolarHBondContact O-N 3.27Å; S97-K100 PolarHBondContact O-N 3.11Å; S97-K100 VanDerWaalsContact O-N 3.15Å; A98-K100 VanDerWaalsContact C-N 3.27Å; A98-K100 PolarHBondContact O-N 2.89Å; K100-E103 WeakPolarHBondContact CD-OE2 3.43Å; K100-E103 WeakPolarHBondContact CE-OE2 2.98Å; K100-E103 IonicContact NZ-OE2 2.66Å; K100-E103 PolarHBondContact NZ-OE2 2.68Å; K100-A104 WeakPolarHBondContact O-CB 3.19Å; K100-A104 PolarHBondContact O-N 3.46Å
101	V	96.8	Very high	88.1	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-41.8	170.9	-179.8	0	0	0	0	110.8	A73 L74 F77 S97 A98 A104 I105 L132 L135	A73-V101 HydrophobicContact CB-CG2 3.88Å; L74-V101 HydrophobicContact CD2-CG1 3.71Å; L74-V101 HydrophobicContact CD2-CG2 3.97Å; L74-V101 HydrophobicContact CG-CG1 4.19Å; L74-V101 HydrophobicContact CG-CG2 4.4Å; F77-V101 HydrophobicContact CB-CG2 4.34Å; S97-V101 PolarHBondContact O-N 2.83Å; S97-V101 VanDerWaalsContact O-N 3.12Å; A98-V101 PolarHBondContact O-N 3.32Å; A98-V101 VanDerWaalsContact O-N 3.14Å; V101-A104 PolarHBondContact O-N 3.23Å; V101-I105 HydrophobicContact CG1-CD1 3.82Å; V101-I105 WeakPolarHBondContact O-CG1 3.13Å; V101-I105 PolarHBondContact O-N 2.98Å; V101-L132 HydrophobicContact CG1-CD1 3.88Å; V101-L135 HydrophobicContact CB-CD2 4.2Å; V101-L135 HydrophobicContact CG1-CD2 3.85Å; V101-L135 HydrophobicContact CG2-CD2 4.23Å
102	L	96	Very high	87.1	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-45.4	172.9	175.3	61.6	0	0	0	112	A98 S99 I105 L106 L132 I136 V896 L901 R905	A98-L102 PolarHBondContact O-N 3.44Å; S99-L102 WeakPolarHBondContact O-CB 3.43Å; S99-L102 PolarHBondContact O-N 2.74Å; L102-I105 PolarHBondContact O-N 3.48Å; L102-L106 PolarHBondContact O-N 3.23Å; L102-L132 HydrophobicContact CD1-CD2 3.85Å; L102-I136 HydrophobicContact CB-CD1 4.17Å; L102-I136 HydrophobicContact CD1-CD1 4.41Å; L102-I136 HydrophobicContact CD2-CD1 4.28Å; L102-V896 HydrophobicContact CD1-CG2 4.29Å; L102-L901 HydrophobicContact CD1-CB 4.07Å; L102-L901 HydrophobicContact CD1-CD2 3.87Å; L102-L901 HydrophobicContact CD1-CG 4.36Å; L102-R905 HydrophobicContact CD2-CB 4.01Å; L102-R905 HydrophobicContact CG-CB 4.49Å
103	E	94.6	Very high	85.8	Confident	68 Å²	68	34.7 Å²	34.7	32%	0.318	20%	0.195	S	C	.	.	H	α-helix	trans	-64.8	-37.6	177	-75.8	-175.1	148.8	0	0	113.1	S99 K100 P107 R905	S99-E103 WeakPolarHBondContact O-CG 3.47Å; S99-E103 PolarHBondContact O-N 3.02Å; K100-E103 WeakPolarHBondContact CD-OE2 3.43Å; K100-E103 WeakPolarHBondContact CE-OE2 2.98Å; K100-E103 IonicContact NZ-OE2 2.66Å; K100-E103 PolarHBondContact NZ-OE2 2.68Å; E103-P107 WeakPolarHBondContact O-CD 3.47Å; E103-R905 HydrophobicContact CG-CG 4.19Å; E103-R905 IonicContact OE1-NH1 2.8Å
104	A	94.9	Very high	84	Confident	14 Å²	14	40 Å²	40	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-72.9	-28.9	178.2	0	0	0	0	0	113.5	E69 V70 A73 K100 V101 P107	E69-A104 HydrophobicContact CB-CB 4.5Å; V70-A104 HydrophobicContact CB-CB 4.46Å; V70-A104 VanDerWaalsContact CG2-C 3.46Å; V70-A104 HydrophobicContact CG2-CB 3.79Å; V70-A104 VanDerWaalsContact CG2-O 3.22Å; V70-A104 WeakPolarHBondContact CG2-O 3.49Å; A73-A104 HydrophobicContact CB-CB 4.14Å; K100-A104 WeakPolarHBondContact O-CB 3.19Å; K100-A104 PolarHBondContact O-N 3.46Å; V101-A104 PolarHBondContact O-N 3.23Å; A104-P107 WeakPolarHBondContact O-CD 3.32Å
105	I	93.6	Very high	82.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-80.4	-26.3	177.8	-70.1	170.4	0	0	0	111.7	V70 V101 L102 L108 V109 V128 L132 V165 V169 L901	V70-I105 HydrophobicContact CB-CG1 4.43Å; V70-I105 HydrophobicContact CG1-CD1 4.22Å; V70-I105 HydrophobicContact CG1-CG1 3.84Å; V70-I105 HydrophobicContact CG2-CB 4.47Å; V70-I105 HydrophobicContact CG2-CG1 3.62Å; V101-I105 HydrophobicContact CG1-CD1 3.82Å; V101-I105 WeakPolarHBondContact O-CG1 3.13Å; V101-I105 PolarHBondContact O-N 2.98Å; L102-I105 PolarHBondContact O-N 3.48Å; I105-L108 PolarHBondContact O-N 3.21Å; I105-L108 VanDerWaalsContact O-N 3.17Å; I105-V109 HydrophobicContact CG2-CG2 3.73Å; I105-V109 PolarHBondContact O-N 2.92Å; I105-V128 HydrophobicContact CG2-CG1 4.06Å; I105-L132 HydrophobicContact CB-CD2 4.28Å; I105-L132 HydrophobicContact CD1-CD1 3.96Å; I105-L132 HydrophobicContact CD1-CD2 3.91Å; I105-L132 HydrophobicContact CD1-CG 4.36Å; I105-L132 HydrophobicContact CG2-CD2 4.13Å; I105-V165 HydrophobicContact CD1-CG1 3.6Å; I105-V169 HydrophobicContact CD1-CG2 4.33Å; I105-V169 HydrophobicContact CG1-CG2 4.34Å; I105-L901 HydrophobicContact CG2-CD1 4.22Å
106	L	90.6	Very high	80.8	Confident	28 Å²	28	47.6 Å²	47.6	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-53	-45	-177	-172.3	69.5	0	0	0	114.1	L102 Q110 L901	L102-L106 PolarHBondContact O-N 3.23Å; L106-Q110 VanDerWaalsContact O-CG 3.31Å; L106-Q110 WeakPolarHBondContact O-CG 3.47Å; L106-Q110 PolarHBondContact O-N 2.87Å; L106-L901 HydrophobicContact CD1-CB 3.52Å; L106-L901 HydrophobicContact CD1-CD1 4.39Å
107	P	87.8	Confident	79.2	Confident	37 Å²	37	54.5 Å²	54.5	24%	0.24	27%	0.268	C	S	.	.	H	α-helix	trans	-68.2	-36.7	178.7	-19.5	33.5	0	0	0	113.3	E103 A104 V109 Q110 I111	E103-P107 WeakPolarHBondContact O-CD 3.47Å; A104-P107 WeakPolarHBondContact O-CD 3.32Å; P107-V109 VanDerWaalsContact C-N 3.31Å; P107-V109 PolarHBondContact O-N 3.47Å; P107-Q110 PolarHBondContact O-N 3Å; P107-I111 WeakPolarHBondContact O-CG1 3.47Å
108	L	83.8	Confident	78.5	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-40.4	179.3	-73.3	174.9	0	0	0	111.8	L63 H66 V70 I105 V169 V173	L63-L108 HydrophobicContact CD2-CD2 4.18Å; H66-L108 HydrophobicContact CB-CD2 3.43Å; H66-L108 VanDerWaalsContact CB-CD2 3.43Å; H66-L108 HydrophobicContact CB-CG 3.77Å; V70-L108 HydrophobicContact CG2-CD1 3.75Å; I105-L108 PolarHBondContact O-N 3.21Å; I105-L108 VanDerWaalsContact O-N 3.17Å; L108-V169 HydrophobicContact CD1-CG1 3.68Å; L108-V173 HydrophobicContact CD2-CG2 3.91Å
109	V	77.3	Confident	77.9	Confident	21 Å²	21	60.4 Å²	60.4	13%	0.127	31%	0.309	C	S	.	.	H	α-helix	trans	-85.9	-15.2	-173	-177.5	0	0	0	0	112.8	I105 P107 I111 H125 Y129 L172 L901	I105-V109 HydrophobicContact CG2-CG2 3.73Å; I105-V109 PolarHBondContact O-N 2.92Å; P107-V109 VanDerWaalsContact C-N 3.31Å; P107-V109 PolarHBondContact O-N 3.47Å; V109-I111 VanDerWaalsContact C-N 3.26Å; V109-I111 PolarHBondContact O-N 3.32Å; V109-H125 WeakPolarHBondContact CG1-ND1 3.42Å; V109-Y129 HydrophobicContact CG1-CE1 3.57Å; V109-Y129 WeakPolarHBondContact CG1-OH 3.16Å; V109-Y129 HydrophobicContact CG2-CE1 4.5Å; V109-L172 HydrophobicContact CG2-CD2 4.05Å; V109-L901 HydrophobicContact CB-CD1 4.41Å
110	Q	73.5	Confident	77.5	Confident	123 Å²	123	61.8 Å²	61.8	58%	0.575	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	5	172.3	-71.8	177.6	-1.3	0	0	113.9	L106 P107 E112 S902	L106-Q110 VanDerWaalsContact O-CG 3.31Å; L106-Q110 WeakPolarHBondContact O-CG 3.47Å; L106-Q110 PolarHBondContact O-N 2.87Å; P107-Q110 PolarHBondContact O-N 3Å; Q110-E112 PolarHBondContact O-N 3.25Å; Q110-S902 PolarHBondContact NE2-OG 2.81Å
111	I	63	Low	77	Confident	45 Å²	45	56.4 Å²	56.4	23%	0.231	30%	0.299	C	S	.	.	S	Bend	trans	-81.4	113.8	-173.5	-72.4	168.4	0	0	0	112.5	L63 P107 V109 T176	L63-I111 HydrophobicContact CD2-CD1 3.44Å; L63-I111 VanDerWaalsContact CD2-CD1 3.44Å; L63-I111 HydrophobicContact CG-CD1 4.16Å; P107-I111 WeakPolarHBondContact O-CG1 3.47Å; V109-I111 VanDerWaalsContact C-N 3.26Å; V109-I111 PolarHBondContact O-N 3.32Å; I111-T176 HydrophobicContact CG2-CG2 4.18Å
112	E	54.4	Low	76.4	Confident	49 Å²	49	58.7 Å²	58.7	23%	0.229	32%	0.315	C	S	.	.			trans	51.7	92	168.2	-65.6	-166.6	113.3	0	0	117.3	K59 Q110 R114 I115 Q180	K59-E112 IonicContact NZ-OE1 2.79Å; K59-E112 PolarHBondContact NZ-OE1 3.25Å; K59-E112 IonicContact NZ-OE2 3.62Å; K59-E112 PolarHBondContact NZ-OE2 3.16Å; Q110-E112 PolarHBondContact O-N 3.25Å; E112-R114 PolarHBondContact O-N 2.92Å; E112-R114 IonicContact OE1-CZ 2.72Å; E112-R114 IonicContact OE1-NE 3.16Å; E112-R114 IonicContact OE1-NH2 2.86Å; E112-R114 PolarHBondContact OE1-NH2 3.36Å; E112-I115 HydrophobicContact CB-CD1 4.04Å; E112-I115 HydrophobicContact CB-CG1 4.01Å; E112-I115 PolarHBondContact O-N 3.39Å; E112-Q180 PolarHBondContact OE2-NE2 3.25Å
113	A	53.7	Low	76.1	Confident	71 Å²	71	62 Å²	62	59%	0.587	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-48.1	-21	164.7	0	0	0	0	0	114.7	I115 Q116	A113-I115 PolarHBondContact O-N 3.03Å; A113-Q116 WeakPolarHBondContact O-CG 3.42Å; A113-Q116 PolarHBondContact O-N 3.34Å
114	R	50.6	Low	75.9	Confident	194 Å²	194	58.7 Å²	58.7	73%	0.732	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-66.9	-12.3	174.2	-67.5	-172.4	-71.9	-140.6	-3	114.8	E112	E112-R114 PolarHBondContact O-N 2.92Å; E112-R114 IonicContact OE1-CZ 2.72Å; E112-R114 IonicContact OE1-NE 3.16Å; E112-R114 IonicContact OE1-NH2 2.86Å; E112-R114 PolarHBondContact OE1-NH2 3.36Å
115	I	57.5	Low	75.7	Confident	27 Å²	27	59.4 Å²	59.4	14%	0.138	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-103	-2.9	-178.1	-39.4	179.9	0	0	0	112	E112 A113 H117 S118 L121 T176 K179	E112-I115 HydrophobicContact CB-CD1 4.04Å; E112-I115 HydrophobicContact CB-CG1 4.01Å; E112-I115 PolarHBondContact O-N 3.39Å; A113-I115 PolarHBondContact O-N 3.03Å; I115-H117 PolarHBondContact O-N 2.78Å; I115-S118 PolarHBondContact O-N 3.24Å; I115-L121 HydrophobicContact CB-CD2 4.04Å; I115-L121 HydrophobicContact CG2-CD2 3.73Å; I115-T176 HydrophobicContact CD1-CG2 4.4Å; I115-K179 HydrophobicContact CG2-CB 4.2Å; I115-K179 HydrophobicContact CG2-CG 4.46Å
116	Q	54.9	Low	75.5	Confident	138 Å²	138	62.8 Å²	62.8	65%	0.645	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-11.6	-175.9	-71.5	-175.2	-7.4	0	0	115.5	A113 S118	A113-Q116 WeakPolarHBondContact O-CG 3.42Å; A113-Q116 PolarHBondContact O-N 3.34Å; Q116-S118 VanDerWaalsContact C-N 3.26Å; Q116-S118 PolarHBondContact O-N 2.92Å
117	H	58.3	Low	75.7	Confident	182 Å²	182	66.8 Å²	66.8	84%	0.843	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-3.8	173.9	-54.3	-56.2	0	0	0	114.1	I115	I115-H117 PolarHBondContact O-N 2.78Å
118	S	79.9	Confident	76	Confident	25 Å²	25	65 Å²	65	18%	0.175	35%	0.349	C	S	.	.			trans	-89.9	105.1	175.5	-167.3	0	0	0	0	111.8	I115 Q116 A120 L121 S122	I115-S118 PolarHBondContact O-N 3.24Å; Q116-S118 VanDerWaalsContact C-N 3.26Å; Q116-S118 PolarHBondContact O-N 2.92Å; S118-A120 PolarHBondContact O-N 3.02Å; S118-L121 PolarHBondContact O-N 3.44Å; S118-S122 PolarHBondContact O-N 3.15Å; S118-S122 PolarHBondContact O-OG 3.28Å
119	S	83.6	Confident	76.5	Confident	102 Å²	102	66.7 Å²	66.7	71%	0.713	36%	0.355	S	S	*	.	H	α-helix	trans	-54.6	-35	175.6	53.1	0	0	0	0	113.7	S123	S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.28Å; S119-S123 PolarHBondContact O-N 2.93Å
120	A	85.8	Confident	77.4	Confident	49 Å²	49	69.8 Å²	69.8	41%	0.405	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-43.9	174.1	0	0	0	0	0	112.3	S118 S123 C124	S118-A120 PolarHBondContact O-N 3.02Å; A120-S123 PolarHBondContact O-N 3.29Å; A120-C124 WeakPolarHBondContact O-CB 3.49Å; A120-C124 PolarHBondContact O-N 3.35Å
121	L	85.4	Confident	78.5	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-67	-44.6	177.5	-162.3	78.3	0	0	0	110.9	I115 S118 S123 C124 H125 L172 L175	I115-L121 HydrophobicContact CB-CD2 4.04Å; I115-L121 HydrophobicContact CG2-CD2 3.73Å; S118-L121 PolarHBondContact O-N 3.44Å; L121-S123 PolarHBondContact O-N 3.45Å; L121-C124 WeakPolarHBondContact O-CB 3.29Å; L121-C124 PolarHBondContact O-N 3.39Å; L121-C124 VanDerWaalsContact O-N 3.13Å; L121-H125 PolarHBondContact O-CD2 2.74Å; L121-H125 PolarHBondContact O-N 3.32Å; L121-L172 HydrophobicContact CD1-CD1 3.65Å; L121-L172 HydrophobicContact CG-CD1 4.1Å; L121-L175 HydrophobicContact CD1-CB 3.81Å
122	S	85.1	Confident	80.1	Confident	49 Å²	49	62.4 Å²	62.4	34%	0.343	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-41.9	176.4	-56.5	0	0	0	0	112.3	S118 C124 H125 S126	S118-S122 PolarHBondContact O-N 3.15Å; S118-S122 PolarHBondContact O-OG 3.28Å; S122-C124 VanDerWaalsContact C-N 3.33Å; S122-C124 PolarHBondContact O-N 2.81Å; S122-H125 PolarHBondContact O-N 3.36Å; S122-S126 PolarHBondContact O-N 2.97Å; S122-S126 PolarHBondContact O-OG 3.36Å
123	S	89.6	Confident	82.1	Confident	69 Å²	69	60.1 Å²	60.1	48%	0.483	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-38.1	173.2	-178	0	0	0	0	112.3	S119 A120 L121 S126 R127	S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.28Å; S119-S123 PolarHBondContact O-N 2.93Å; A120-S123 PolarHBondContact O-N 3.29Å; L121-S123 PolarHBondContact O-N 3.45Å; S123-S126 PolarHBondContact O-N 2.9Å; S123-R127 PolarHBondContact O-N 3.37Å
124	C	91	Very high	84.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-46.5	174.6	-160.2	0	0	0	0	111.5	A120 L121 S122 S126 R127 V128 L172 L175	A120-C124 WeakPolarHBondContact O-CB 3.49Å; A120-C124 PolarHBondContact O-N 3.35Å; L121-C124 WeakPolarHBondContact O-CB 3.29Å; L121-C124 PolarHBondContact O-N 3.39Å; L121-C124 VanDerWaalsContact O-N 3.13Å; S122-C124 VanDerWaalsContact C-N 3.33Å; S122-C124 PolarHBondContact O-N 2.81Å; C124-S126 PolarHBondContact O-N 2.86Å; C124-R127 WeakPolarHBondContact O-CB 3.4Å; C124-R127 PolarHBondContact O-N 2.85Å; C124-R127 VanDerWaalsContact O-N 3.12Å; C124-V128 WeakPolarHBondContact O-CG2 3.41Å; C124-V128 PolarHBondContact O-N 3.25Å; C124-L172 HydrophobicContact CB-CD1 4.47Å; C124-L172 PolarHBondContact SG-N 2.93Å; C124-L172 VanDerWaalsContact SG-N 3.4Å; C124-L175 HydrophobicContact CB-CD1 4.03Å
125	H	89.4	Confident	86.3	Confident	28 Å²	28	49.7 Å²	49.7	13%	0.13	27%	0.273	C	S	.	.	H	α-helix	trans	-55.5	-50.1	173.2	-74	-66.5	0	0	0	111.8	V109 L121 S122 R127 V128 Y129 L172	V109-H125 WeakPolarHBondContact CG1-ND1 3.42Å; L121-H125 PolarHBondContact O-CD2 2.74Å; L121-H125 PolarHBondContact O-N 3.32Å; S122-H125 PolarHBondContact O-N 3.36Å; H125-R127 VanDerWaalsContact C-N 3.25Å; H125-R127 PolarHBondContact O-N 2.9Å; H125-V128 PolarHBondContact O-N 3.4Å; H125-V128 VanDerWaalsContact O-N 3.12Å; H125-Y129 HydrophobicContact CB-CE2 4.05Å; H125-Y129 WeakPolarHBondContact O-CB 3.47Å; H125-Y129 VanDerWaalsContact O-CD2 3.31Å; H125-Y129 WeakPolarHBondContact O-CD2 3.25Å; H125-Y129 PolarHBondContact O-N 3.03Å; H125-L172 VanDerWaalsContact CE1-CD1 3.44Å; H125-L172 WeakPolarHBondContact CE1-CD1 3.23Å
126	S	90.9	Very high	88.1	Confident	72 Å²	72	48.4 Å²	48.4	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-57.4	-37.2	176.4	-61	0	0	0	0	112.8	S122 S123 C124 Q130	S122-S126 PolarHBondContact O-N 2.97Å; S122-S126 PolarHBondContact O-OG 3.36Å; S123-S126 PolarHBondContact O-N 2.9Å; C124-S126 PolarHBondContact O-N 2.86Å; S126-Q130 WeakPolarHBondContact O-CB 3.47Å; S126-Q130 PolarHBondContact O-N 3.07Å
127	R	93.5	Very high	90	Very high	111 Å²	111	47.5 Å²	47.5	42%	0.419	26%	0.257	S	S	.	.	H	α-helix	trans	-69.8	-39.3	176.7	-152	-167.2	-49.2	148.7	14	112.3	S123 C124 H125 S131 E171	S123-R127 PolarHBondContact O-N 3.37Å; C124-R127 WeakPolarHBondContact O-CB 3.4Å; C124-R127 PolarHBondContact O-N 2.85Å; C124-R127 VanDerWaalsContact O-N 3.12Å; H125-R127 VanDerWaalsContact C-N 3.25Å; H125-R127 PolarHBondContact O-N 2.9Å; R127-S131 WeakPolarHBondContact O-CB 3.45Å; R127-S131 PolarHBondContact O-N 3Å; R127-S131 PolarHBondContact O-OG 3.04Å; R127-E171 IonicContact CZ-OE1 3.47Å; R127-E171 IonicContact CZ-OE2 3.54Å; R127-E171 IonicContact NH1-OE1 3.42Å; R127-E171 PolarHBondContact NH1-OE1 3.39Å; R127-E171 IonicContact NH1-OE2 2.68Å; R127-E171 PolarHBondContact NH1-OE2 3.17Å; R127-E171 IonicContact NH2-OE1 2.65Å; R127-E171 PolarHBondContact NH2-OE1 2.93Å; R127-E171 IonicContact NH2-OE2 3.76Å
128	V	94.1	Very high	91.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-47.6	173.8	171.4	0	0	0	0	110.5	I105 C124 H125 S131 L132 G168 V169	I105-V128 HydrophobicContact CG2-CG1 4.06Å; C124-V128 WeakPolarHBondContact O-CG2 3.41Å; C124-V128 PolarHBondContact O-N 3.25Å; H125-V128 PolarHBondContact O-N 3.4Å; H125-V128 VanDerWaalsContact O-N 3.12Å; V128-S131 PolarHBondContact O-N 2.96Å; V128-L132 VanDerWaalsContact O-CB 3.27Å; V128-L132 WeakPolarHBondContact O-CB 3.23Å; V128-L132 PolarHBondContact O-N 3.05Å; V128-G168 VanDerWaalsContact CG2-C 3.43Å; V128-V169 HydrophobicContact CG1-CG2 4.02Å; V128-V169 HydrophobicContact CG2-CG2 4.26Å
129	Y	95.2	Very high	92.2	Very high	39 Å²	39	39.6 Å²	39.6	15%	0.153	22%	0.216	C	C	.	.	H	α-helix	trans	-56	-51.4	175.2	-65.8	-31	0	0	0	112.1	V109 H125 S131 L132 G133 V896 G899 L901	V109-Y129 HydrophobicContact CG1-CE1 3.57Å; V109-Y129 WeakPolarHBondContact CG1-OH 3.16Å; V109-Y129 HydrophobicContact CG2-CE1 4.5Å; H125-Y129 HydrophobicContact CB-CE2 4.05Å; H125-Y129 WeakPolarHBondContact O-CB 3.47Å; H125-Y129 VanDerWaalsContact O-CD2 3.31Å; H125-Y129 WeakPolarHBondContact O-CD2 3.25Å; H125-Y129 PolarHBondContact O-N 3.03Å; Y129-S131 VanDerWaalsContact C-N 3.31Å; Y129-S131 PolarHBondContact O-N 3.24Å; Y129-L132 PolarHBondContact O-N 2.93Å; Y129-G133 PolarHBondContact O-N 3.42Å; Y129-V896 WeakPolarHBondContact CB-O 3.31Å; Y129-G899 VanDerWaalsContact CE1-CA 3.48Å; Y129-L901 HydrophobicContact CD1-CD1 4.38Å; Y129-L901 HydrophobicContact CD1-CD2 4.06Å; Y129-L901 HydrophobicContact CD1-CG 4.39Å; Y129-L901 HydrophobicContact CE1-CD1 3.97Å; Y129-L901 HydrophobicContact CE1-CD2 4.19Å; Y129-L901 HydrophobicContact CE1-CG 4.02Å
130	Q	96.1	Very high	92.6	Very high	87 Å²	87	35 Å²	35	41%	0.407	18%	0.183	S	C	.	.	H	α-helix	trans	-63.6	-37.1	-179	-170.7	62	78.9	0	0	112.5	S126 N134 C897	S126-Q130 WeakPolarHBondContact O-CB 3.47Å; S126-Q130 PolarHBondContact O-N 3.07Å; Q130-N134 PolarHBondContact O-N 3.35Å; Q130-N134 VanDerWaalsContact O-N 3.11Å; Q130-N134 PolarHBondContact O-ND2 3Å; Q130-N134 VanDerWaalsContact O-ND2 3.08Å; Q130-C897 PolarHBondContact NE2-SG 3.29Å; Q130-C897 VanDerWaalsContact NE2-SG 3.41Å
131	S	96.4	Very high	92.8	Very high	13 Å²	13	37 Å²	37	9%	0.091	18%	0.184	C	C	.	.	H	α-helix	trans	-70.2	-41.8	177.2	-54.7	0	0	0	0	111.6	R127 V128 Y129 N134 L135 V161 V165	R127-S131 WeakPolarHBondContact O-CB 3.45Å; R127-S131 PolarHBondContact O-N 3Å; R127-S131 PolarHBondContact O-OG 3.04Å; V128-S131 PolarHBondContact O-N 2.96Å; Y129-S131 VanDerWaalsContact C-N 3.31Å; Y129-S131 PolarHBondContact O-N 3.24Å; S131-N134 PolarHBondContact O-N 2.8Å; S131-L135 PolarHBondContact O-N 3.18Å; S131-V161 WeakPolarHBondContact O-CG1 3.47Å; S131-V165 VanDerWaalsContact C-CG2 3.47Å; S131-V165 WeakPolarHBondContact O-CG2 3.15Å
132	L	96.6	Very high	92.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-41.9	176.7	178.6	57.2	0	0	0	111.7	V101 L102 I105 V128 Y129 N134 L135 I136 V896 L901	V101-L132 HydrophobicContact CG1-CD1 3.88Å; L102-L132 HydrophobicContact CD1-CD2 3.85Å; I105-L132 HydrophobicContact CB-CD2 4.28Å; I105-L132 HydrophobicContact CD1-CD1 3.96Å; I105-L132 HydrophobicContact CD1-CD2 3.91Å; I105-L132 HydrophobicContact CD1-CG 4.36Å; I105-L132 HydrophobicContact CG2-CD2 4.13Å; V128-L132 VanDerWaalsContact O-CB 3.27Å; V128-L132 WeakPolarHBondContact O-CB 3.23Å; V128-L132 PolarHBondContact O-N 3.05Å; Y129-L132 PolarHBondContact O-N 2.93Å; L132-N134 VanDerWaalsContact C-N 3.34Å; L132-N134 PolarHBondContact O-N 3.36Å; L132-L135 WeakPolarHBondContact O-CB 3.17Å; L132-L135 PolarHBondContact O-N 3.48Å; L132-I136 HydrophobicContact CD1-CD1 3.87Å; L132-I136 HydrophobicContact CD1-CG1 4.26Å; L132-I136 HydrophobicContact CG-CD1 3.87Å; L132-I136 WeakPolarHBondContact O-CB 3.34Å; L132-I136 WeakPolarHBondContact O-CG1 2.85Å; L132-I136 PolarHBondContact O-N 2.95Å; L132-V896 HydrophobicContact CB-CG1 4.09Å; L132-V896 HydrophobicContact CD2-CG1 4.12Å; L132-V896 HydrophobicContact CG-CG1 3.86Å; L132-L901 HydrophobicContact CD2-CD2 4.2Å
133	G	96.6	Very high	92.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.4	-46.8	173.4	0	0	0	0	0	111.1	Y129 L135 I136 R137 F893	Y129-G133 PolarHBondContact O-N 3.42Å; G133-L135 VanDerWaalsContact C-N 3.34Å; G133-L135 PolarHBondContact O-N 2.9Å; G133-I136 PolarHBondContact O-N 3.34Å; G133-R137 WeakPolarHBondContact O-CB 3.31Å; G133-R137 PolarHBondContact O-N 2.88Å; G133-F893 VanDerWaalsContact C-CD2 3.5Å; G133-F893 VanDerWaalsContact O-CD2 3.32Å; G133-F893 WeakPolarHBondContact O-CD2 3.28Å
134	N	96.1	Very high	92.6	Very high	46 Å²	46	35.2 Å²	35.2	25%	0.246	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-35.8	176.1	-77.4	-39.6	0	0	0	113.2	Q130 S131 L132 R137 W138 V161	Q130-N134 PolarHBondContact O-N 3.35Å; Q130-N134 VanDerWaalsContact O-N 3.11Å; Q130-N134 PolarHBondContact O-ND2 3Å; Q130-N134 VanDerWaalsContact O-ND2 3.08Å; S131-N134 PolarHBondContact O-N 2.8Å; L132-N134 VanDerWaalsContact C-N 3.34Å; L132-N134 PolarHBondContact O-N 3.36Å; N134-R137 PolarHBondContact OD1-NH2 3.33Å; N134-W138 WeakPolarHBondContact O-CB 3.39Å; N134-W138 PolarHBondContact O-N 3.46Å; N134-V161 HydrophobicContact CB-CG1 4.12Å; N134-V161 HydrophobicContact CB-CG2 4.46Å
135	L	96	Very high	92.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-43.7	174.6	-171	72.9	0	0	0	111.7	L74 F77 V101 S131 L132 G133 A139 V158 V161 I162 V165	L74-L135 HydrophobicContact CD2-CD2 3.92Å; F77-L135 HydrophobicContact CD1-CD1 4.06Å; F77-L135 HydrophobicContact CE1-CD1 3.56Å; F77-L135 HydrophobicContact CE1-CG 4.34Å; F77-L135 HydrophobicContact CE2-CG 4.47Å; F77-L135 HydrophobicContact CZ-CD1 3.83Å; F77-L135 HydrophobicContact CZ-CG 4.18Å; V101-L135 HydrophobicContact CB-CD2 4.2Å; V101-L135 HydrophobicContact CG1-CD2 3.85Å; V101-L135 HydrophobicContact CG2-CD2 4.23Å; S131-L135 PolarHBondContact O-N 3.18Å; L132-L135 WeakPolarHBondContact O-CB 3.17Å; L132-L135 PolarHBondContact O-N 3.48Å; G133-L135 VanDerWaalsContact C-N 3.34Å; G133-L135 PolarHBondContact O-N 2.9Å; L135-A139 PolarHBondContact O-N 3.44Å; L135-A139 VanDerWaalsContact O-N 3.11Å; L135-V158 HydrophobicContact CD1-CG2 4.33Å; L135-V161 HydrophobicContact CB-CG1 3.83Å; L135-V161 HydrophobicContact CD1-CG1 4.06Å; L135-I162 HydrophobicContact CD1-CG1 3.71Å; L135-V165 HydrophobicContact CB-CG2 4.45Å; L135-V165 HydrophobicContact CD2-CG2 4.47Å
136	I	95.8	Very high	91.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.4	-51.7	179.6	-72	166.2	0	0	0	110.7	A98 L102 L132 G133 W138 A139 D140 V892 V896	A98-I136 HydrophobicContact CB-CG1 4.28Å; L102-I136 HydrophobicContact CB-CD1 4.17Å; L102-I136 HydrophobicContact CD1-CD1 4.41Å; L102-I136 HydrophobicContact CD2-CD1 4.28Å; L132-I136 HydrophobicContact CD1-CD1 3.87Å; L132-I136 HydrophobicContact CD1-CG1 4.26Å; L132-I136 HydrophobicContact CG-CD1 3.87Å; L132-I136 WeakPolarHBondContact O-CB 3.34Å; L132-I136 WeakPolarHBondContact O-CG1 2.85Å; L132-I136 PolarHBondContact O-N 2.95Å; G133-I136 PolarHBondContact O-N 3.34Å; I136-W138 VanDerWaalsContact C-N 3.27Å; I136-W138 PolarHBondContact O-N 3.02Å; I136-A139 PolarHBondContact O-N 3.06Å; I136-D140 VanDerWaalsContact O-CG 3.31Å; I136-D140 PolarHBondContact O-N 3.02Å; I136-V892 HydrophobicContact CG2-CG1 4.22Å; I136-V896 HydrophobicContact CD1-CG1 4.3Å; I136-V896 HydrophobicContact CD1-CG2 3.85Å
137	R	94.8	Very high	90.5	Very high	119 Å²	119	38.7 Å²	38.7	45%	0.449	19%	0.186	S	C	.	.	H	α-helix	trans	-59.5	-36.5	178.8	-176.7	171.5	61.9	119.5	0.4	112.3	G133 N134 D140 Q141 F893	G133-R137 WeakPolarHBondContact O-CB 3.31Å; G133-R137 PolarHBondContact O-N 2.88Å; N134-R137 PolarHBondContact OD1-NH2 3.33Å; R137-D140 PolarHBondContact O-N 2.75Å; R137-Q141 WeakPolarHBondContact O-CB 3.49Å; R137-Q141 PolarHBondContact O-N 3Å; R137-F893 HydrophobicContact CB-CD2 3.75Å; R137-F893 HydrophobicContact CB-CE2 4.27Å; R137-F893 HydrophobicContact CB-CG 4.41Å; R137-F893 HydrophobicContact CG-CD2 4.37Å
138	W	91.8	Very high	89.3	Confident	42 Å²	42	39 Å²	39	16%	0.159	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-48.5	171.4	-178.5	90.3	0	0	0	111.4	F77 V81 M84 L94 N134 I136 D140 Q141 V142 I147 V158	F77-W138 HydrophobicContact CE1-CE3 4.46Å; F77-W138 HydrophobicContact CE1-CZ3 4.21Å; F77-W138 AromaticContact CZ-CE3 3.93Å; F77-W138 HydrophobicContact CZ-CE3 3.93Å; F77-W138 AromaticContact CZ-CZ3 3.81Å; F77-W138 HydrophobicContact CZ-CZ3 3.81Å; V81-W138 HydrophobicContact CG2-CH2 4.08Å; V81-W138 HydrophobicContact CG2-CZ3 4.14Å; M84-W138 HydrophobicContact CE-CH2 3.67Å; M84-W138 HydrophobicContact CE-CZ2 4.06Å; L94-W138 HydrophobicContact CD1-CH2 3.86Å; L94-W138 HydrophobicContact CD1-CZ3 3.8Å; L94-W138 HydrophobicContact CD2-CZ3 4.05Å; L94-W138 HydrophobicContact CG-CZ3 4.49Å; N134-W138 WeakPolarHBondContact O-CB 3.39Å; N134-W138 PolarHBondContact O-N 3.46Å; I136-W138 VanDerWaalsContact C-N 3.27Å; I136-W138 PolarHBondContact O-N 3.02Å; W138-D140 PolarHBondContact O-N 3.25Å; W138-Q141 PolarHBondContact O-N 2.89Å; W138-V142 HydrophobicContact CD2-CG2 4Å; W138-V142 HydrophobicContact CE3-CG2 4.17Å; W138-V142 HydrophobicContact CH2-CG2 3.92Å; W138-V142 HydrophobicContact CZ2-CG2 3.75Å; W138-V142 HydrophobicContact CZ3-CG2 4.14Å; W138-V142 WeakPolarHBondContact O-CG2 3.46Å; W138-V142 PolarHBondContact O-N 3.47Å; W138-V142 VanDerWaalsContact O-N 3.08Å; W138-I147 HydrophobicContact CH2-CD1 4.01Å; W138-I147 HydrophobicContact CZ2-CD1 3.75Å; W138-V158 HydrophobicContact CD2-CB 3.83Å; W138-V158 HydrophobicContact CD2-CG2 3.58Å; W138-V158 HydrophobicContact CE3-CB 4.23Å; W138-V158 HydrophobicContact CE3-CG2 3.52Å; W138-V158 HydrophobicContact CG-CB 4.29Å; W138-V158 HydrophobicContact CG-CG2 4.2Å; W138-V158 HydrophobicContact CH2-CB 4.35Å; W138-V158 HydrophobicContact CH2-CG1 4.13Å; W138-V158 HydrophobicContact CH2-CG2 4.13Å; W138-V158 HydrophobicContact CZ2-CB 3.93Å; W138-V158 HydrophobicContact CZ2-CG1 3.79Å; W138-V158 HydrophobicContact CZ2-CG2 4.16Å; W138-V158 HydrophobicContact CZ3-CB 4.48Å; W138-V158 HydrophobicContact CZ3-CG2 3.81Å
139	A	92.6	Very high	87.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-28.6	179.1	0	0	0	0	0	113.4	F77 A98 L135 I136 M143	F77-A139 HydrophobicContact CE2-CB 4.1Å; F77-A139 HydrophobicContact CZ-CB 4.26Å; A98-A139 HydrophobicContact CB-CB 3.74Å; L135-A139 PolarHBondContact O-N 3.44Å; L135-A139 VanDerWaalsContact O-N 3.11Å; I136-A139 PolarHBondContact O-N 3.06Å; A139-M143 PolarHBondContact O-N 3Å
140	D	92.3	Very high	86.1	Confident	5 Å²	5	47 Å²	47	3%	0.027	24%	0.241	C	C	.	.	H	α-helix	trans	-77.6	-45.3	176.1	-68.6	-19.5	0	0	0	112.4	I136 R137 W138 V142 M143 L144 M889 R908	I136-D140 VanDerWaalsContact O-CG 3.31Å; I136-D140 PolarHBondContact O-N 3.02Å; R137-D140 PolarHBondContact O-N 2.75Å; W138-D140 PolarHBondContact O-N 3.25Å; D140-V142 PolarHBondContact O-N 2.67Å; D140-M143 WeakPolarHBondContact O-CA 3.47Å; D140-M143 WeakPolarHBondContact O-CB 3.44Å; D140-M143 PolarHBondContact O-N 2.89Å; D140-L144 PolarHBondContact O-N 2.64Å; D140-L144 VanDerWaalsContact O-N 3.08Å; D140-M889 HydrophobicContact CB-CE 4.3Å; D140-M889 HydrophobicContact CB-CG 4.26Å; D140-M889 HydrophobicContact CB-SD 3.83Å; D140-R908 IonicContact OD1-CZ 3.78Å; D140-R908 IonicContact OD1-NH1 3.61Å; D140-R908 PolarHBondContact OD1-NH1 3.19Å; D140-R908 IonicContact OD1-NH2 3.24Å; D140-R908 PolarHBondContact OD1-NH2 2.98Å; D140-R908 IonicContact OD2-CZ 2.74Å; D140-R908 IonicContact OD2-NH1 3.86Å; D140-R908 PolarHBondContact OD2-NH1 3.32Å; D140-R908 IonicContact OD2-NH2 2.81Å
141	Q	89	Confident	84.9	Confident	92 Å²	92	46.3 Å²	46.3	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-53.3	-40.8	172.7	-178.8	60.5	29.9	0	0	111.4	R137 W138 M143 L144 D145	R137-Q141 WeakPolarHBondContact O-CB 3.49Å; R137-Q141 PolarHBondContact O-N 3Å; W138-Q141 PolarHBondContact O-N 2.89Å; Q141-M143 VanDerWaalsContact C-N 3.29Å; Q141-M143 PolarHBondContact O-N 2.85Å; Q141-L144 PolarHBondContact O-N 2.86Å; Q141-D145 PolarHBondContact NE2-OD2 2.97Å; Q141-D145 PolarHBondContact O-N 3.49Å
142	V	87.4	Confident	83.6	Confident	11 Å²	11	52.7 Å²	52.7	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-66.8	-25.7	175.9	170.7	0	0	0	0	113.3	L91 L94 W138 D140 G146 I147	L91-V142 HydrophobicContact CD2-CG1 3.97Å; L94-V142 HydrophobicContact CD1-CG1 3.62Å; W138-V142 HydrophobicContact CD2-CG2 4Å; W138-V142 HydrophobicContact CE3-CG2 4.17Å; W138-V142 HydrophobicContact CH2-CG2 3.92Å; W138-V142 HydrophobicContact CZ2-CG2 3.75Å; W138-V142 HydrophobicContact CZ3-CG2 4.14Å; W138-V142 WeakPolarHBondContact O-CG2 3.46Å; W138-V142 PolarHBondContact O-N 3.47Å; W138-V142 VanDerWaalsContact O-N 3.08Å; D140-V142 PolarHBondContact O-N 2.67Å; V142-G146 VanDerWaalsContact O-CA 3.27Å; V142-G146 WeakPolarHBondContact O-CA 3.29Å; V142-G146 PolarHBondContact O-N 2.89Å; V142-I147 HydrophobicContact CB-CD1 4.28Å; V142-I147 HydrophobicContact CB-CG1 4.21Å; V142-I147 HydrophobicContact CG1-CD1 3.7Å; V142-I147 HydrophobicContact CG1-CG1 3.83Å; V142-I147 HydrophobicContact CG2-CD1 3.56Å; V142-I147 HydrophobicContact CG2-CG1 3.57Å
143	M	86.2	Confident	82.7	Confident	38 Å²	38	60.1 Å²	60.1	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-80.9	-32	175	-169.7	174.8	62.4	0	0	112.8	P95 A139 D140 Q141 M889 L912 V915	P95-M143 HydrophobicContact CB-SD 3.96Å; P95-M143 HydrophobicContact CG-CB 3.74Å; P95-M143 HydrophobicContact CG-CG 3.94Å; P95-M143 HydrophobicContact CG-SD 3.58Å; P95-M143 VanDerWaalsContact CG-SD 3.58Å; A139-M143 PolarHBondContact O-N 3Å; D140-M143 WeakPolarHBondContact O-CA 3.47Å; D140-M143 WeakPolarHBondContact O-CB 3.44Å; D140-M143 PolarHBondContact O-N 2.89Å; Q141-M143 VanDerWaalsContact C-N 3.29Å; Q141-M143 PolarHBondContact O-N 2.85Å; M143-M889 HydrophobicContact CE-CE 3.27Å; M143-L912 HydrophobicContact CE-CD2 3.85Å; M143-L912 HydrophobicContact SD-CD2 3.99Å; M143-V915 HydrophobicContact CE-CB 4.4Å; M143-V915 HydrophobicContact CE-CG1 4.04Å; M143-V915 HydrophobicContact CE-CG2 4.16Å; M143-V915 HydrophobicContact SD-CG1 3.74Å
144	L	83.8	Confident	81.7	Confident	36 Å²	36	61.1 Å²	61.1	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-77	-67	179.4	-65	176.5	0	0	0	111.4	D140 Q141 L885 K886 M889	D140-L144 PolarHBondContact O-N 2.64Å; D140-L144 VanDerWaalsContact O-N 3.08Å; Q141-L144 PolarHBondContact O-N 2.86Å; L144-L885 HydrophobicContact CD2-CD2 3.47Å; L144-L885 VanDerWaalsContact CD2-CD2 3.47Å; L144-L885 HydrophobicContact CD2-CG 3.84Å; L144-K886 HydrophobicContact CD1-CG 3.67Å; L144-M889 HydrophobicContact CD1-SD 3.83Å; L144-M889 HydrophobicContact CD2-CE 4.27Å; L144-M889 HydrophobicContact CD2-SD 4.14Å; L144-M889 HydrophobicContact CG-SD 4.06Å
145	D	81.4	Confident	80.9	Confident	110 Å²	110	60.7 Å²	60.7	59%	0.588	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-8.2	-167.7	-61.2	-24.1	0	0	0	112	Q141	Q141-D145 PolarHBondContact NE2-OD2 2.97Å; Q141-D145 PolarHBondContact O-N 3.49Å
146	G	75.1	Confident	80.2	Confident	34 Å²	34	66.4 Å²	66.4	35%	0.351	34%	0.336	S	S	.	.			trans	80.9	-155.8	-174.4	0	0	0	0	0	113	V142	V142-G146 VanDerWaalsContact O-CA 3.27Å; V142-G146 WeakPolarHBondContact O-CA 3.29Å; V142-G146 PolarHBondContact O-N 2.89Å
147	I	70.9	Confident	79.6	Confident	30 Å²	30	68.6 Å²	68.6	15%	0.154	35%	0.354	C	S	.	.			trans	-134.9	134.2	170.5	-67.4	175.6	0	0	0	107.5	M84 L91 W138 V142 L149	M84-I147 HydrophobicContact CE-CD1 4.07Å; M84-I147 HydrophobicContact SD-CD1 3.37Å; M84-I147 WeakPolarHBondContact SD-CD1 3.41Å; M84-I147 HydrophobicContact SD-CG2 4.45Å; L91-I147 HydrophobicContact CD2-CD1 3.87Å; W138-I147 HydrophobicContact CH2-CD1 4.01Å; W138-I147 HydrophobicContact CZ2-CD1 3.75Å; V142-I147 HydrophobicContact CB-CD1 4.28Å; V142-I147 HydrophobicContact CB-CG1 4.21Å; V142-I147 HydrophobicContact CG1-CD1 3.7Å; V142-I147 HydrophobicContact CG1-CG1 3.83Å; V142-I147 HydrophobicContact CG2-CD1 3.56Å; V142-I147 HydrophobicContact CG2-CG1 3.57Å; I147-L149 HydrophobicContact CG2-CD2 4.16Å
148	D	66.3	Low	79.3	Confident	116 Å²	116	62.9 Å²	62.9	62%	0.62	33%	0.333	S	S	*	.			trans	-77.5	113.9	157.7	-170.7	-12.4	0	0	0	108.5	D150 D151	D148-D150 PolarHBondContact O-N 3.02Å; D148-D150 PolarHBondContact OD1-N 3Å; D148-D151 WeakPolarHBondContact O-CB 3.49Å; D148-D151 PolarHBondContact O-N 3.36Å
149	L	62.1	Low	79.1	Confident	76 Å²	76	63.5 Å²	63.5	40%	0.398	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.8	-172.5	-67.2	174.1	0	0	0	113.1	M84 I147	M84-L149 HydrophobicContact CG-CD2 4.17Å; M84-L149 HydrophobicContact SD-CD2 4.42Å; I147-L149 HydrophobicContact CG2-CD2 4.16Å
150	D	61	Low	79.1	Confident	131 Å²	131	66.9 Å²	66.9	70%	0.701	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.4	171	-79.3	-44.7	0	0	0	112.9	D148 K152	D148-D150 PolarHBondContact O-N 3.02Å; D148-D150 PolarHBondContact OD1-N 3Å; D150-K152 VanDerWaalsContact C-N 3.34Å; D150-K152 PolarHBondContact O-N 3.34Å
151	D	70.8	Confident	79.2	Confident	73 Å²	73	68 Å²	68	39%	0.39	37%	0.372	S	S	.	.			trans	-75.1	84.1	171.6	-176.8	2	0	0	0	111.8	D148 E153 S154	D148-D151 WeakPolarHBondContact O-CB 3.49Å; D148-D151 PolarHBondContact O-N 3.36Å; D151-E153 PolarHBondContact O-N 3.13Å; D151-E153 WeakPolarHBondContact OD1-CA 3.44Å; D151-E153 WeakPolarHBondContact OD1-CB 3.15Å; D151-E153 PolarHBondContact OD1-N 2.82Å; D151-S154 PolarHBondContact O-N 2.95Å; D151-S154 PolarHBondContact O-OG 3.38Å; D151-S154 PolarHBondContact OD1-N 3.2Å; D151-S154 WeakPolarHBondContact OD2-CB 3.39Å
152	K	69.8	Low	79.4	Confident	147 Å²	147	64.2 Å²	64.2	64%	0.639	36%	0.355	S	S	*	.	H	α-helix	trans	-67.3	-20.4	172.3	-68.8	162.3	-173.2	156.2	0	113.1	D150 I156	D150-K152 VanDerWaalsContact C-N 3.34Å; D150-K152 PolarHBondContact O-N 3.34Å; K152-I156 WeakPolarHBondContact O-CD1 3.47Å; K152-I156 VanDerWaalsContact O-CG1 3.3Å; K152-I156 WeakPolarHBondContact O-CG1 3.38Å; K152-I156 PolarHBondContact O-N 3.39Å
153	E	77	Confident	79.8	Confident	157 Å²	157	69.9 Å²	69.9	73%	0.734	38%	0.378	S	S	*	.	H	α-helix	trans	-71.8	-37.8	177.9	-54.8	-165	168.5	0	0	110.2	D151 V155 I156 A157	D151-E153 PolarHBondContact O-N 3.13Å; D151-E153 WeakPolarHBondContact OD1-CA 3.44Å; D151-E153 WeakPolarHBondContact OD1-CB 3.15Å; D151-E153 PolarHBondContact OD1-N 2.82Å; E153-V155 VanDerWaalsContact C-N 3.34Å; E153-V155 PolarHBondContact O-N 3.41Å; E153-I156 PolarHBondContact O-N 3.07Å; E153-A157 VanDerWaalsContact O-CB 3.29Å; E153-A157 WeakPolarHBondContact O-CB 3.24Å; E153-A157 PolarHBondContact O-N 3.5Å
154	S	76.2	Confident	80.2	Confident	20 Å²	20	70 Å²	70	14%	0.14	39%	0.385	C	S	.	.	H	α-helix	trans	-57.1	-42.1	172.6	76.9	0	0	0	0	113.3	D151 A157 V158	D151-S154 PolarHBondContact O-N 2.95Å; D151-S154 PolarHBondContact O-OG 3.38Å; D151-S154 PolarHBondContact OD1-N 3.2Å; D151-S154 WeakPolarHBondContact OD2-CB 3.39Å; S154-A157 PolarHBondContact O-N 2.95Å; S154-V158 PolarHBondContact O-N 2.75Å
155	V	77.9	Confident	80.7	Confident	37 Å²	37	68.3 Å²	68.3	22%	0.224	38%	0.376	C	S	.	.	H	α-helix	trans	-71.4	-36.8	-179	-176.6	0	0	0	0	111.2	M84 E153 V158 T159	M84-V155 HydrophobicContact SD-CG2 4.31Å; E153-V155 VanDerWaalsContact C-N 3.34Å; E153-V155 PolarHBondContact O-N 3.41Å; V155-V158 WeakPolarHBondContact O-CG1 3.29Å; V155-T159 WeakPolarHBondContact O-CB 3.46Å; V155-T159 PolarHBondContact O-N 2.67Å; V155-T159 VanDerWaalsContact O-N 3.14Å; V155-T159 PolarHBondContact O-OG1 3.24Å
156	I	81.8	Confident	81.4	Confident	120 Å²	120	65 Å²	65	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-67.8	-42.2	172.6	-68	166.6	0	0	0	110.3	K152 E153 T159 S160	K152-I156 WeakPolarHBondContact O-CD1 3.47Å; K152-I156 VanDerWaalsContact O-CG1 3.3Å; K152-I156 WeakPolarHBondContact O-CG1 3.38Å; K152-I156 PolarHBondContact O-N 3.39Å; E153-I156 PolarHBondContact O-N 3.07Å; I156-T159 WeakPolarHBondContact O-CB 3.27Å; I156-T159 PolarHBondContact O-N 3.27Å; I156-S160 PolarHBondContact O-N 2.72Å
157	A	84.5	Confident	82.3	Confident	46 Å²	46	66.4 Å²	66.4	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-52.1	178.3	0	0	0	0	0	111.6	E153 S154 T159 S160 V161	E153-A157 VanDerWaalsContact O-CB 3.29Å; E153-A157 WeakPolarHBondContact O-CB 3.24Å; E153-A157 PolarHBondContact O-N 3.5Å; S154-A157 PolarHBondContact O-N 2.95Å; A157-T159 VanDerWaalsContact C-N 3.29Å; A157-T159 PolarHBondContact O-N 3.08Å; A157-S160 WeakPolarHBondContact O-CB 3.47Å; A157-S160 PolarHBondContact O-N 3.26Å; A157-S160 PolarHBondContact O-OG 2.77Å; A157-V161 WeakPolarHBondContact O-CG2 3.36Å; A157-V161 PolarHBondContact O-N 3.11Å
158	V	87.2	Confident	83.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-62.9	-35.6	177.2	69.9	0	0	0	0	112	F77 V81 L135 W138 S154 V155 S160 V161 I162	F77-V158 HydrophobicContact CE1-CG2 3.92Å; F77-V158 HydrophobicContact CZ-CG2 4.49Å; V81-V158 HydrophobicContact CG1-CG1 3.84Å; V81-V158 HydrophobicContact CG2-CG1 4.41Å; V81-V158 HydrophobicContact CG2-CG2 4.47Å; L135-V158 HydrophobicContact CD1-CG2 4.33Å; W138-V158 HydrophobicContact CD2-CB 3.83Å; W138-V158 HydrophobicContact CD2-CG2 3.58Å; W138-V158 HydrophobicContact CE3-CB 4.23Å; W138-V158 HydrophobicContact CE3-CG2 3.52Å; W138-V158 HydrophobicContact CG-CB 4.29Å; W138-V158 HydrophobicContact CG-CG2 4.2Å; W138-V158 HydrophobicContact CH2-CB 4.35Å; W138-V158 HydrophobicContact CH2-CG1 4.13Å; W138-V158 HydrophobicContact CH2-CG2 4.13Å; W138-V158 HydrophobicContact CZ2-CB 3.93Å; W138-V158 HydrophobicContact CZ2-CG1 3.79Å; W138-V158 HydrophobicContact CZ2-CG2 4.16Å; W138-V158 HydrophobicContact CZ3-CB 4.48Å; W138-V158 HydrophobicContact CZ3-CG2 3.81Å; S154-V158 PolarHBondContact O-N 2.75Å; V155-V158 WeakPolarHBondContact O-CG1 3.29Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 3.08Å; V158-V161 PolarHBondContact O-N 2.88Å; V158-V161 VanDerWaalsContact O-N 3.13Å; V158-I162 HydrophobicContact CG2-CD1 4.19Å; V158-I162 HydrophobicContact CG2-CG1 4.38Å; V158-I162 VanDerWaalsContact O-CG1 3.31Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 3.07Å
159	T	88.8	Confident	84.6	Confident	55 Å²	55	59.6 Å²	59.6	34%	0.337	32%	0.323	S	S	.	.	H	α-helix	trans	-61	-37.5	173.9	-60.6	0	0	0	0	111.8	V155 I156 A157 K163	V155-T159 WeakPolarHBondContact O-CB 3.46Å; V155-T159 PolarHBondContact O-N 2.67Å; V155-T159 VanDerWaalsContact O-N 3.14Å; V155-T159 PolarHBondContact O-OG1 3.24Å; I156-T159 WeakPolarHBondContact O-CB 3.27Å; I156-T159 PolarHBondContact O-N 3.27Å; A157-T159 VanDerWaalsContact C-N 3.29Å; A157-T159 PolarHBondContact O-N 3.08Å; T159-K163 PolarHBondContact O-N 3.03Å
160	S	92.2	Very high	86.1	Confident	70 Å²	70	59.9 Å²	59.9	49%	0.49	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-37.4	173.6	83.1	0	0	0	0	112.7	I156 A157 V158 K163 A164	I156-S160 PolarHBondContact O-N 2.72Å; A157-S160 WeakPolarHBondContact O-CB 3.47Å; A157-S160 PolarHBondContact O-N 3.26Å; A157-S160 PolarHBondContact O-OG 2.77Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 3.08Å; S160-K163 PolarHBondContact O-N 3.27Å; S160-A164 PolarHBondContact O-N 3.05Å
161	V	93.3	Very high	87.5	Confident	28 Å²	28	57 Å²	57	17%	0.17	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-44.2	177.7	175.6	0	0	0	0	111.4	S131 N134 L135 A157 V158 K163 A164 V165	S131-V161 WeakPolarHBondContact O-CG1 3.47Å; N134-V161 HydrophobicContact CB-CG1 4.12Å; N134-V161 HydrophobicContact CB-CG2 4.46Å; L135-V161 HydrophobicContact CB-CG1 3.83Å; L135-V161 HydrophobicContact CD1-CG1 4.06Å; A157-V161 WeakPolarHBondContact O-CG2 3.36Å; A157-V161 PolarHBondContact O-N 3.11Å; V158-V161 PolarHBondContact O-N 2.88Å; V158-V161 VanDerWaalsContact O-N 3.13Å; V161-K163 PolarHBondContact O-N 2.92Å; V161-A164 PolarHBondContact O-N 3.2Å; V161-A164 VanDerWaalsContact O-N 3.08Å; V161-V165 WeakPolarHBondContact O-CG2 3.23Å; V161-V165 PolarHBondContact O-N 2.95Å
162	I	94.1	Very high	88.5	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-54.9	-43.6	172.9	-68.5	164.1	0	0	0	110.3	L74 F77 K78 V81 L135 V158 L166	L74-I162 HydrophobicContact CD2-CG2 4.42Å; F77-I162 HydrophobicContact CD1-CD1 3.71Å; F77-I162 HydrophobicContact CD1-CG1 3.94Å; F77-I162 HydrophobicContact CE1-CD1 3.95Å; F77-I162 HydrophobicContact CE1-CG1 4.14Å; K78-I162 HydrophobicContact CB-CD1 4.21Å; K78-I162 HydrophobicContact CG-CD1 4.21Å; V81-I162 HydrophobicContact CG2-CD1 4.42Å; L135-I162 HydrophobicContact CD1-CG1 3.71Å; V158-I162 HydrophobicContact CG2-CD1 4.19Å; V158-I162 HydrophobicContact CG2-CG1 4.38Å; V158-I162 VanDerWaalsContact O-CG1 3.31Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 3.07Å; I162-L166 WeakPolarHBondContact O-CB 3.31Å; I162-L166 PolarHBondContact O-N 3.25Å; I162-L166 VanDerWaalsContact O-N 3.13Å
163	K	94.5	Very high	89.4	Confident	129 Å²	129	46.9 Å²	46.9	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-65.7	-42.9	175.6	-176.4	-179.2	172.6	-173.4	0	112.1	T159 S160 V161 V165 L166 D167	T159-K163 PolarHBondContact O-N 3.03Å; S160-K163 PolarHBondContact O-N 3.27Å; V161-K163 PolarHBondContact O-N 2.92Å; K163-V165 PolarHBondContact O-N 3.33Å; K163-L166 PolarHBondContact O-N 2.93Å; K163-D167 WeakPolarHBondContact CE-OD2 3.17Å; K163-D167 WeakPolarHBondContact CG-OD2 3.15Å; K163-D167 WeakPolarHBondContact O-CB 3.27Å; K163-D167 PolarHBondContact O-N 2.77Å
164	A	95.6	Very high	90	Very high	41 Å²	41	45.7 Å²	45.7	34%	0.339	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-41.5	179.4	0	0	0	0	0	112.7	S160 V161 G168	S160-A164 PolarHBondContact O-N 3.05Å; V161-A164 PolarHBondContact O-N 3.2Å; V161-A164 VanDerWaalsContact O-N 3.08Å; A164-G168 PolarHBondContact O-N 3.14Å
165	V	94.9	Very high	90.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.9	-48.4	172.6	-179.1	0	0	0	0	110.6	L74 I105 S131 L135 V161 K163 V169	L74-V165 HydrophobicContact CD1-CB 4.33Å; L74-V165 HydrophobicContact CD1-CG1 4.01Å; L74-V165 HydrophobicContact CD2-CB 4.36Å; L74-V165 HydrophobicContact CD2-CG1 4.21Å; I105-V165 HydrophobicContact CD1-CG1 3.6Å; S131-V165 VanDerWaalsContact C-CG2 3.47Å; S131-V165 WeakPolarHBondContact O-CG2 3.15Å; L135-V165 HydrophobicContact CB-CG2 4.45Å; L135-V165 HydrophobicContact CD2-CG2 4.47Å; V161-V165 WeakPolarHBondContact O-CG2 3.23Å; V161-V165 PolarHBondContact O-N 2.95Å; K163-V165 PolarHBondContact O-N 3.33Å; V165-V169 HydrophobicContact CG1-CG2 4.46Å; V165-V169 WeakPolarHBondContact O-CB 3.47Å; V165-V169 VanDerWaalsContact O-CG2 3.32Å; V165-V169 WeakPolarHBondContact O-CG2 3.42Å; V165-V169 PolarHBondContact O-N 2.9Å
166	L	94.9	Very high	90.8	Very high	41 Å²	41	44.8 Å²	44.8	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-47.4	-178.4	177.6	61.1	0	0	0	112.9	V71 L74 I162 K163 V169 K170	V71-L166 HydrophobicContact CG2-CD1 3.71Å; L74-L166 HydrophobicContact CD1-CB 3.95Å; L74-L166 HydrophobicContact CD1-CD1 4.36Å; I162-L166 WeakPolarHBondContact O-CB 3.31Å; I162-L166 PolarHBondContact O-N 3.25Å; I162-L166 VanDerWaalsContact O-N 3.13Å; K163-L166 PolarHBondContact O-N 2.93Å; L166-V169 PolarHBondContact O-N 2.74Å; L166-K170 WeakPolarHBondContact O-CG 3.5Å; L166-K170 PolarHBondContact O-N 3.35Å; L166-K170 VanDerWaalsContact O-N 3.11Å
167	D	94.5	Very high	91	Very high	63 Å²	63	40.5 Å²	40.5	34%	0.337	22%	0.219	S	C	.	.	H	α-helix	trans	-73.6	-35	-176.7	-69.6	-15.9	0	0	0	111.1	K163 K170 E171	K163-D167 WeakPolarHBondContact CE-OD2 3.17Å; K163-D167 WeakPolarHBondContact CG-OD2 3.15Å; K163-D167 WeakPolarHBondContact O-CB 3.27Å; K163-D167 PolarHBondContact O-N 2.77Å; D167-K170 PolarHBondContact O-N 3.13Å; D167-K170 IonicContact OD1-NZ 2.67Å; D167-K170 PolarHBondContact OD1-NZ 3.37Å; D167-E171 WeakPolarHBondContact O-CB 3.24Å; D167-E171 PolarHBondContact O-N 3.1Å
168	G	93.6	Very high	90.9	Very high	3 Å²	3	42.1 Å²	42.1	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-40.4	170.6	0	0	0	0	0	113.3	V128 A164 E171 L172	V128-G168 VanDerWaalsContact CG2-C 3.43Å; A164-G168 PolarHBondContact O-N 3.14Å; G168-E171 PolarHBondContact O-N 2.82Å; G168-L172 WeakPolarHBondContact O-CB 3.38Å; G168-L172 PolarHBondContact O-N 3.21Å
169	V	92.7	Very high	90.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-39.5	177.2	162.4	0	0	0	0	112	E67 V70 I105 L108 V128 V165 L166 L172 V173	E67-V169 HydrophobicContact CG-CG1 4.22Å; V70-V169 HydrophobicContact CB-CG1 4.39Å; V70-V169 HydrophobicContact CG1-CG1 4.22Å; V70-V169 HydrophobicContact CG1-CG2 4.28Å; I105-V169 HydrophobicContact CD1-CG2 4.33Å; I105-V169 HydrophobicContact CG1-CG2 4.34Å; L108-V169 HydrophobicContact CD1-CG1 3.68Å; V128-V169 HydrophobicContact CG1-CG2 4.02Å; V128-V169 HydrophobicContact CG2-CG2 4.26Å; V165-V169 HydrophobicContact CG1-CG2 4.46Å; V165-V169 WeakPolarHBondContact O-CB 3.47Å; V165-V169 VanDerWaalsContact O-CG2 3.32Å; V165-V169 WeakPolarHBondContact O-CG2 3.42Å; V165-V169 PolarHBondContact O-N 2.9Å; L166-V169 PolarHBondContact O-N 2.74Å; V169-L172 PolarHBondContact O-N 3.29Å; V169-V173 WeakPolarHBondContact O-CG2 2.97Å; V169-V173 PolarHBondContact O-N 3.26Å
170	K	92.5	Very high	89.5	Confident	82 Å²	82	46.2 Å²	46.2	36%	0.357	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-42.9	172.7	-71.2	167.1	-172.8	162.7	0	112.6	L166 D167 L172 V173 K174	L166-K170 WeakPolarHBondContact O-CG 3.5Å; L166-K170 PolarHBondContact O-N 3.35Å; L166-K170 VanDerWaalsContact O-N 3.11Å; D167-K170 PolarHBondContact O-N 3.13Å; D167-K170 IonicContact OD1-NZ 2.67Å; D167-K170 PolarHBondContact OD1-NZ 3.37Å; K170-L172 VanDerWaalsContact C-N 3.31Å; K170-V173 PolarHBondContact O-N 3.35Å; K170-K174 WeakPolarHBondContact O-CB 3.45Å; K170-K174 PolarHBondContact O-N 3.37Å
171	E	91.8	Very high	88.4	Confident	69 Å²	69	49.5 Å²	49.5	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-42.6	175.9	-170.3	180	133.6	0	0	110.7	R127 D167 G168 K174 L175	R127-E171 IonicContact CZ-OE1 3.47Å; R127-E171 IonicContact CZ-OE2 3.54Å; R127-E171 IonicContact NH1-OE1 3.42Å; R127-E171 PolarHBondContact NH1-OE1 3.39Å; R127-E171 IonicContact NH1-OE2 2.68Å; R127-E171 PolarHBondContact NH1-OE2 3.17Å; R127-E171 IonicContact NH2-OE1 2.65Å; R127-E171 PolarHBondContact NH2-OE1 2.93Å; R127-E171 IonicContact NH2-OE2 3.76Å; D167-E171 WeakPolarHBondContact O-CB 3.24Å; D167-E171 PolarHBondContact O-N 3.1Å; G168-E171 PolarHBondContact O-N 2.82Å; E171-K174 PolarHBondContact O-N 3.34Å; E171-L175 HydrophobicContact CG-CD1 4Å; E171-L175 HydrophobicContact CG-CG 4.45Å; E171-L175 WeakPolarHBondContact O-CB 3.29Å; E171-L175 VanDerWaalsContact O-CG 3.25Å; E171-L175 WeakPolarHBondContact O-CG 3.37Å; E171-L175 PolarHBondContact O-N 2.93Å
172	L	90	Very high	86.6	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-48.8	176.6	-179.8	65.6	0	0	0	112.3	V109 L121 C124 H125 G168 V169 K170 L175 T176	V109-L172 HydrophobicContact CG2-CD2 4.05Å; L121-L172 HydrophobicContact CD1-CD1 3.65Å; L121-L172 HydrophobicContact CG-CD1 4.1Å; C124-L172 HydrophobicContact CB-CD1 4.47Å; C124-L172 PolarHBondContact SG-N 2.93Å; C124-L172 VanDerWaalsContact SG-N 3.4Å; H125-L172 VanDerWaalsContact CE1-CD1 3.44Å; H125-L172 WeakPolarHBondContact CE1-CD1 3.23Å; G168-L172 WeakPolarHBondContact O-CB 3.38Å; G168-L172 PolarHBondContact O-N 3.21Å; V169-L172 PolarHBondContact O-N 3.29Å; K170-L172 VanDerWaalsContact C-N 3.31Å; L172-L175 PolarHBondContact O-N 3.06Å; L172-T176 WeakPolarHBondContact O-CB 3.38Å; L172-T176 PolarHBondContact O-N 2.95Å; L172-T176 PolarHBondContact O-OG1 3.25Å
173	V	89.2	Confident	84.4	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-47.7	177.6	167.5	0	0	0	0	110.4	L63 E67 L108 V169 K170 L175 T176 I177	L63-V173 HydrophobicContact CB-CG1 4.38Å; E67-V173 HydrophobicContact CB-CG2 4.18Å; E67-V173 HydrophobicContact CG-CG2 4.29Å; L108-V173 HydrophobicContact CD2-CG2 3.91Å; V169-V173 WeakPolarHBondContact O-CG2 2.97Å; V169-V173 PolarHBondContact O-N 3.26Å; K170-V173 PolarHBondContact O-N 3.35Å; V173-L175 PolarHBondContact O-N 2.53Å; V173-T176 PolarHBondContact O-N 3.5Å; V173-I177 HydrophobicContact CG1-CD1 3.76Å; V173-I177 WeakPolarHBondContact O-CG1 3.43Å; V173-I177 PolarHBondContact O-N 2.9Å
174	K	89.8	Confident	81.6	Confident	133 Å²	133	58.1 Å²	58.1	58%	0.578	30%	0.301	S	S	*	.	H	α-helix	trans	-57.5	-51.7	176.5	-173.6	-159.1	167.8	-159.4	0	111.9	K170 E171 T176 I177 E178	K170-K174 WeakPolarHBondContact O-CB 3.45Å; K170-K174 PolarHBondContact O-N 3.37Å; E171-K174 PolarHBondContact O-N 3.34Å; K174-T176 VanDerWaalsContact C-N 3.27Å; K174-T176 PolarHBondContact O-N 2.97Å; K174-I177 PolarHBondContact O-N 3.22Å; K174-E178 IonicContact NZ-OE2 3.79Å; K174-E178 WeakPolarHBondContact O-CB 3.49Å; K174-E178 PolarHBondContact O-N 3.15Å
175	L	87.1	Confident	79.2	Confident	32 Å²	32	62.3 Å²	62.3	17%	0.168	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-35.3	-179.7	-73	172.3	0	0	0	112	L121 C124 E171 L172 V173 K179	L121-L175 HydrophobicContact CD1-CB 3.81Å; C124-L175 HydrophobicContact CB-CD1 4.03Å; E171-L175 HydrophobicContact CG-CD1 4Å; E171-L175 HydrophobicContact CG-CG 4.45Å; E171-L175 WeakPolarHBondContact O-CB 3.29Å; E171-L175 VanDerWaalsContact O-CG 3.25Å; E171-L175 WeakPolarHBondContact O-CG 3.37Å; E171-L175 PolarHBondContact O-N 2.93Å; L172-L175 PolarHBondContact O-N 3.06Å; V173-L175 PolarHBondContact O-N 2.53Å; L175-K179 WeakPolarHBondContact O-CB 3.5Å; L175-K179 WeakPolarHBondContact O-CG 3.47Å; L175-K179 PolarHBondContact O-N 2.94Å
176	T	84.6	Confident	76.6	Confident	6 Å²	6	67.9 Å²	67.9	4%	0.037	36%	0.359	C	S	.	.	H	α-helix	trans	-67.7	-42.6	176.8	-53.7	0	0	0	0	111.4	L63 I111 I115 L172 V173 K174 Q180	L63-T176 HydrophobicContact CD1-CG2 3.71Å; L63-T176 HydrophobicContact CD2-CG2 4.04Å; I111-T176 HydrophobicContact CG2-CG2 4.18Å; I115-T176 HydrophobicContact CD1-CG2 4.4Å; L172-T176 WeakPolarHBondContact O-CB 3.38Å; L172-T176 PolarHBondContact O-N 2.95Å; L172-T176 PolarHBondContact O-OG1 3.25Å; V173-T176 PolarHBondContact O-N 3.5Å; K174-T176 VanDerWaalsContact C-N 3.27Å; K174-T176 PolarHBondContact O-N 2.97Å; T176-Q180 VanDerWaalsContact O-CB 3.31Å; T176-Q180 WeakPolarHBondContact O-CB 3.3Å; T176-Q180 PolarHBondContact O-N 3.4Å
177	I	84.8	Confident	73.5	Confident	30 Å²	30	72.4 Å²	72.4	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-64.9	-49.5	175.2	-65.1	164.1	0	0	0	110.2	V60 L63 V173 K174 K179 Q180 E181	V60-I177 HydrophobicContact CG1-CD1 3.96Å; V60-I177 HydrophobicContact CG1-CG1 4.09Å; V60-I177 HydrophobicContact CG1-CG2 4.23Å; V60-I177 HydrophobicContact CG2-CG1 4.41Å; V60-I177 HydrophobicContact CG2-CG2 4.21Å; L63-I177 HydrophobicContact CD1-CG1 4.07Å; V173-I177 HydrophobicContact CG1-CD1 3.76Å; V173-I177 WeakPolarHBondContact O-CG1 3.43Å; V173-I177 PolarHBondContact O-N 2.9Å; K174-I177 PolarHBondContact O-N 3.22Å; I177-K179 VanDerWaalsContact C-N 3.27Å; I177-K179 PolarHBondContact O-N 3.33Å; I177-Q180 CarbonylContact O-C 3.6Å; I177-Q180 WeakPolarHBondContact O-CA 3.28Å; I177-Q180 PolarHBondContact O-N 2.91Å; I177-E181 HydrophobicContact CG2-CG 4.33Å; I177-E181 PolarHBondContact O-N 2.9Å
178	E	83.1	Confident	71.3	Confident	79 Å²	79	75.2 Å²	75.2	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-57.2	-38.7	-179.9	-167.2	178.2	141.5	0	0	112.1	K174 Q182	K174-E178 IonicContact NZ-OE2 3.79Å; K174-E178 WeakPolarHBondContact O-CB 3.49Å; K174-E178 PolarHBondContact O-N 3.15Å; E178-Q182 PolarHBondContact O-N 3.48Å
179	K	76	Confident	68.4	Low	101 Å²	101	83.3 Å²	83.3	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-76.1	-21.7	173.7	-70	-63.1	175.5	-159.2	0	114.8	I115 L175 I177	I115-K179 HydrophobicContact CG2-CB 4.2Å; I115-K179 HydrophobicContact CG2-CG 4.46Å; L175-K179 WeakPolarHBondContact O-CB 3.5Å; L175-K179 WeakPolarHBondContact O-CG 3.47Å; L175-K179 PolarHBondContact O-N 2.94Å; I177-K179 VanDerWaalsContact C-N 3.27Å; I177-K179 PolarHBondContact O-N 3.33Å
180	Q	71	Confident	65.4	Low	40 Å²	40	92.6 Å²	92.6	19%	0.187	49%	0.493	C	S	.	.	H	α-helix	trans	-85.8	-24.8	176.6	-166.1	161.7	102.4	0	0	112.6	K59 E112 T176 I177	K59-Q180 VanDerWaalsContact CD-OE1 3.26Å; E112-Q180 PolarHBondContact OE2-NE2 3.25Å; T176-Q180 VanDerWaalsContact O-CB 3.31Å; T176-Q180 WeakPolarHBondContact O-CB 3.3Å; T176-Q180 PolarHBondContact O-N 3.4Å; I177-Q180 CarbonylContact O-C 3.6Å; I177-Q180 WeakPolarHBondContact O-CA 3.28Å; I177-Q180 PolarHBondContact O-N 2.91Å
181	E	68.2	Low	62.8	Low	140 Å²	140	94.5 Å²	94.5	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-84.4	-26.1	173.2	-66.4	-170.7	151.5	0	0	113.4	I177 P183	I177-E181 HydrophobicContact CG2-CG 4.33Å; I177-E181 PolarHBondContact O-N 2.9Å; E181-P183 VanDerWaalsContact O-CD 3.3Å; E181-P183 WeakPolarHBondContact O-CD 3.5Å
182	Q	56.8	Low	59.9	Low	140 Å²	140	95.7 Å²	95.7	65%	0.654	54%	0.535	S	S	*	.			trans	-116.4	82.1	179.2	-63.4	-169.2	21.9	0	0	114.1	E178 S184	E178-Q182 PolarHBondContact O-N 3.48Å; Q182-S184 PolarHBondContact O-N 2.97Å
183	P	47.1	Very low	57.4	Low	110 Å²	110	101 Å²	101	71%	0.714	57%	0.569	S	S	*	*			trans	-69.4	121.5	159.2	29.8	-32	0	0	0	110	E181	E181-P183 VanDerWaalsContact O-CD 3.3Å; E181-P183 WeakPolarHBondContact O-CD 3.5Å
184	S	35.5	Very low	55	Low	102 Å²	102	106.8 Å²	106.8	71%	0.713	61%	0.607	S	S	*	*			trans	-58.6	127.6	-173.4	-54.7	0	0	0	0	113.7	Q182	Q182-S184 PolarHBondContact O-N 2.97Å
185	P	44.7	Very low	52.2	Low	129 Å²	129	106.8 Å²	106.8	84%	0.838	62%	0.618	S	S	*	*			trans	-87.1	112	173.7	32.6	-31.2	0	0	0	111.3
186	T	39.8	Very low	49.4	Very low	116 Å²	116	112 Å²	112	71%	0.712	65%	0.651	S	S	*	*			trans	-139.6	90.4	-179.2	-26.8	0	0	0	0	113.7
187	T	30.5	Very low	46.5	Very low	136 Å²	136	117.4 Å²	117.4	83%	0.834	69%	0.685	S	S	*	*			trans	-170.6	126.3	145.2	6.5	0	0	0	0	110.5
188	P	48.7	Very low	43.8	Very low	122 Å²	122	121.9 Å²	121.9	79%	0.792	71%	0.713	S	S	*	*			trans	-73.6	145.5	169.7	-15.8	31	0	0	0	111.9
189	N	32.4	Very low	41.2	Very low	173 Å²	173	126.6 Å²	126.6	93%	0.925	74%	0.735	S	S	*	*			trans	-61.3	135.1	176.2	-77.4	-42.2	0	0	0	112.4
190	K	29.5	Very low	38.9	Very low	197 Å²	197	126.7 Å²	126.7	86%	0.857	75%	0.749	S	S	*	*			trans	-118.7	132.3	155.5	-168.9	176.3	-178.1	-179.7	0	107.6
191	P	38.2	Very low	36.8	Very low	122 Å²	122	131.9 Å²	131.9	79%	0.792	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.7	152.4	-172	27.7	-35.4	0	0	0	112.8
192	A	30.7	Very low	35	Very low	93 Å²	93	131.2 Å²	131.2	77%	0.769	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.8	179.5	0	0	0	0	0	112.8
193	P	38.1	Very low	33.5	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76.1	159.8	167.7	34	-35.2	0	0	0	111.7
194	P	39.5	Very low	32.6	Very low	127 Å²	127	130 Å²	130	83%	0.825	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.9	161.9	176.7	32.6	-35.8	0	0	0	113
195	V	30.6	Very low	32.1	Very low	134 Å²	134	133.1 Å²	133.1	81%	0.812	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-91.2	128.9	179.1	176.5	0	0	0	0	111.4
196	T	26.7	Very low	31.6	Very low	140 Å²	140	132.8 Å²	132.8	86%	0.859	79%	0.786	S	S	*	*			trans	-145.4	129.7	149.9	40.4	0	0	0	0	110.5
197	T	25.1	Very low	31.8	Very low	121 Å²	121	132 Å²	132	74%	0.742	78%	0.783	S	S	*	*			trans	-84.3	140.8	169.6	48.4	0	0	0	0	111.3
198	T	27.7	Very low	31.6	Very low	123 Å²	123	132.3 Å²	132.3	76%	0.755	78%	0.779	S	S	*	*				179.6	126.5	123.8	32.9	0	0	0	0	112.9
199	E	27.6	Very low	30.9	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	77%	0.774	S	S	*	*			trans	61.5	137.8	136.2	-58.5	-173.2	161.8	0	0	124.8
200	S	29.6	Very low	30.7	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	76%	0.762	S	S	*	*			trans	87.2	105.7	144	71.3	0	0	0	0	122.2
201	N	27	Very low	30.7	Very low	148 Å²	148	126.3 Å²	126.3	79%	0.791	75%	0.752	S	S	*	*				53	115.6	122.9	-65.2	-0.8	0	0	0	123.9
202	V	29.5	Very low	30.2	Very low	127 Å²	127	129 Å²	129	77%	0.77	75%	0.754	S	S	*	*				73.6	113.6	118.2	178.7	0	0	0	0	120.4
203	S	26.2	Very low	30.3	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	76%	0.755	S	S	*	*			trans	89.6	125.9	138.6	-76.5	0	0	0	0	124.7
204	V	27.2	Very low	30	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.715	75%	0.753	S	S	*	*				93.3	123.4	118.8	166	0	0	0	0	122.8
205	E	24	Very low	29.8	Very low	168 Å²	168	133.7 Å²	133.7	79%	0.785	75%	0.747	S	S	*	*			trans	59.8	144.2	143.9	-68.1	179.4	109	0	0	127.8
206	V	35.1	Very low	29.6	Very low	123 Å²	123	132.5 Å²	132.5	75%	0.745	75%	0.745	S	S	*	*			trans	-42.3	-169.9	143.9	-120.5	0	0	0	0	114.8
207	P	45	Very low	29.6	Very low	99 Å²	99	130.9 Å²	130.9	64%	0.643	74%	0.739	S	S	*	*			cis	-103	-160.5	16.1	9	17.4	0	0	0	113.5	I209	P207-I209 HydrophobicContact CB-CD1 4.31Å
208	L	25.2	Very low	29.8	Very low	143 Å²	143	136.7 Å²	136.7	75%	0.749	75%	0.747	S	S	*	*			cis	-130.8	168.7	13.5	-85	85.1	0	0	0	110.5
209	I	34.6	Very low	29.6	Very low	132 Å²	132	137.5 Å²	137.5	68%	0.677	75%	0.752	S	S	*	*			cis	83.4	126.6	27	-57.3	171.1	0	0	0	111.2	P207	P207-I209 HydrophobicContact CB-CD1 4.31Å
210	D	26.7	Very low	29.5	Very low	127 Å²	127	133 Å²	133	68%	0.679	75%	0.745	S	S	*	*				-157.3	159.7	56	-137.1	-37.6	0	0	0	116.3
211	T	30.9	Very low	30.5	Very low	107 Å²	107	133.5 Å²	133.5	66%	0.656	75%	0.746	S	S	*	*			trans	25	159.9	152.8	35.4	0	0	0	0	124.2
212	E	27.7	Very low	30.5	Very low	178 Å²	178	132.3 Å²	132.3	83%	0.832	74%	0.744	S	S	*	*			cis	-154.5	-176.5	12.2	-140.4	154.9	-137.9	0	0	115.1
213	Q	32.3	Very low	30.2	Very low	168 Å²	168	132.8 Å²	132.8	79%	0.785	75%	0.747	S	S	*	*			trans	-90.9	176.1	-176.8	-83.7	173.7	-84.2	0	0	114.2
214	E	31.8	Very low	30.4	Very low	149 Å²	149	132.9 Å²	132.9	70%	0.696	75%	0.748	S	S	*	*			cis	-177.5	172.7	-22.8	-173.3	-169.3	151.7	0	0	109.5
215	V	35.3	Very low	31.2	Very low	116 Å²	116	133.4 Å²	133.4	70%	0.703	75%	0.754	S	S	*	*			trans	98.2	125.9	153.8	-172	0	0	0	0	121.7
216	S	27.1	Very low	31.4	Very low	109 Å²	109	130 Å²	130	76%	0.762	75%	0.754	S	S	*	*			trans	8.8	157.4	150	-73.3	0	0	0	0	124.4
217	S	26.1	Very low	30.9	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	76%	0.76	S	S	*	*			cis	-172.4	145.8	-8.3	52.2	0	0	0	0	114.9
218	R	28.5	Very low	30	Very low	244 Å²	244	135 Å²	135	92%	0.921	77%	0.767	S	S	*	*			trans	51.1	116.3	142.5	-149.3	-178.9	-155.7	178.4	6.3	121.8
219	T	25.1	Very low	29.9	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	77%	0.766	S	S	*	*				167.7	157.8	121.7	-66.8	0	0	0	0	111.9
220	A	24.3	Very low	30.3	Very low	84 Å²	84	131 Å²	131	69%	0.694	77%	0.765	S	S	*	*			trans	-113	-155.2	-172.6	0	0	0	0	0	111.7
221	P	50.9	Low	30.3	Very low	115 Å²	115	132.8 Å²	132.8	75%	0.747	77%	0.769	S	S	*	*			cis	-134.7	-160.4	-14.4	39.7	-18.9	0	0	0	113.6
222	V	26.3	Very low	30.3	Very low	122 Å²	122	134.1 Å²	134.1	74%	0.739	77%	0.772	S	S	*	*			trans	159.1	135.1	133.3	157.4	0	0	0	0	117.1
223	T	24.2	Very low	30.4	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	76%	0.764	S	S	*	*			trans	69.9	143.4	162.7	40.1	0	0	0	0	125.5
224	S	30.4	Very low	30.3	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	76%	0.757	S	S	*	*			trans	-114.3	-179	160.1	66.1	0	0	0	0	109.5
225	P	43.5	Very low	30.3	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	76%	0.764	S	S	*	*				-152.8	-152.5	65.7	41.4	-17.4	0	0	0	115
226	A	28.5	Very low	30.3	Very low	96 Å²	96	132.8 Å²	132.8	79%	0.793	77%	0.766	S	S	*	*			trans	-124.6	161.6	-164	0	0	0	0	0	117.7
227	K	25.4	Very low	30.5	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.865	77%	0.765	S	S	*	*			trans	-158.6	144.8	157.8	-92.4	-173.1	174.5	-178.7	0	107.3
228	V	25	Very low	30.9	Very low	129 Å²	129	132.6 Å²	132.6	78%	0.782	77%	0.765	S	S	*	*			cis	77.5	86.3	43.9	-173.9	0	0	0	0	114.8
229	A	23.1	Very low	32.7	Very low	89 Å²	89	126.6 Å²	126.6	74%	0.736	76%	0.757	S	S	*	*			trans	50.6	178.7	135.8	0	0	0	0	0	120.4
230	P	43.7	Very low	33.6	Very low	100 Å²	100	126.1 Å²	126.1	65%	0.649	76%	0.757	S	S	*	*			cis	-137.6	-169.8	-6.2	46.6	-29.5	0	0	0	115.3
231	E	25.5	Very low	34	Very low	166 Å²	166	131.6 Å²	131.6	78%	0.776	77%	0.765	S	S	*	*			trans	56.8	157.7	149.3	-69.4	167.6	147.9	0	0	121.1
232	L	31.3	Very low	34.4	Very low	135 Å²	135	131.7 Å²	131.7	71%	0.707	77%	0.765	S	S	*	*			cis	-160.5	-172.8	-25.9	-106.6	172.8	0	0	0	105.9
233	Q	30.6	Very low	34.9	Very low	142 Å²	142	131.8 Å²	131.8	66%	0.664	77%	0.769	S	S	*	*			cis	-138	-141.6	6.6	-141.7	158.3	-92.8	0	0	107.1
234	D	29.4	Very low	35.4	Very low	121 Å²	121	133 Å²	133	65%	0.647	77%	0.769	S	S	*	*			cis	-165.5	159.5	-5.5	-108.4	-32.3	0	0	0	103.7
235	E	32.2	Very low	36.2	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	77%	0.768	S	S	*	*			cis	-153.9	169.6	-8.2	-96	-171.5	118.5	0	0	105
236	D	34.8	Very low	35.4	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	77%	0.768	S	S	*	*			cis	-166.3	177.2	-47	-176	35.2	0	0	0	109
237	V	32.3	Very low	35.6	Very low	123 Å²	123	135.3 Å²	135.3	75%	0.745	77%	0.765	S	S	*	*			trans	108.7	128.2	150.1	-171.1	0	0	0	0	117.5
238	A	33.8	Very low	35.7	Very low	88 Å²	88	135.2 Å²	135.2	73%	0.727	76%	0.764	S	S	*	*			trans	-138.5	-129.1	172.7	0	0	0	0	0	114
239	P	66	Low	36	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	77%	0.765	S	S	*	*				-117	-178.7	-114	40	-26	0	0	0	115.8
240	P	44.9	Very low	36.2	Very low	130 Å²	130	134.9 Å²	134.9	84%	0.844	76%	0.762	S	S	*	*				-146.6	-174.9	125.1	36.4	-18.9	0	0	0	116.7
241	K	32.6	Very low	35.5	Very low	199 Å²	199	137.5 Å²	137.5	87%	0.865	77%	0.765	S	S	*	*			trans	-110.2	-154.9	-176.1	-62.3	177.6	177.9	176.1	0	112.3
242	P	59	Low	35.8	Very low	116 Å²	116	136.3 Å²	136.3	75%	0.753	76%	0.764	S	S	*	*				-115.3	-172.9	-87.8	40.7	-24.6	0	0	0	113.2
243	P	36.8	Very low	35.9	Very low	125 Å²	125	134.9 Å²	134.9	81%	0.812	77%	0.765	S	S	*	*				-156	-174.2	94.9	41.6	-21.4	0	0	0	117.3
244	L	34.2	Very low	37	Very low	164 Å²	164	133.6 Å²	133.6	86%	0.859	77%	0.769	S	S	*	*			trans	-112.4	179.3	168.3	-87.9	166	0	0	0	108.9
245	P	47.8	Very low	38.3	Very low	111 Å²	111	133.4 Å²	133.4	72%	0.721	77%	0.774	S	S	*	*			cis	-149.9	-150.9	27.2	44.4	-20.2	0	0	0	116.9
246	E	26.9	Very low	39.9	Very low	181 Å²	181	130.7 Å²	130.7	85%	0.846	77%	0.772	S	S	*	*			trans	82.1	113.1	175.9	-50.1	-151.5	138.8	0	0	116.2
247	A	31.8	Very low	39.5	Very low	87 Å²	87	128.9 Å²	128.9	72%	0.719	78%	0.776	S	S	*	*			cis	98.8	134.2	35.7	0	0	0	0	0	111.6
248	K	28.1	Very low	39.4	Very low	197 Å²	197	131.2 Å²	131.2	86%	0.857	78%	0.784	S	S	*	*			cis	-151.7	176.3	22.3	-59.5	164.9	-169.1	169.1	0	107.5
249	V	31.2	Very low	41	Very low	130 Å²	130	132.5 Å²	132.5	79%	0.788	78%	0.784	S	S	*	*			cis	-178.2	150.1	-18.6	145.8	0	0	0	0	102.7
250	A	28.1	Very low	39.9	Very low	81 Å²	81	132.7 Å²	132.7	67%	0.669	79%	0.786	S	S	*	*			cis	-129.5	175.6	23.8	0	0	0	0	0	110.4
251	E	29.1	Very low	39.1	Very low	156 Å²	156	135.7 Å²	135.7	73%	0.729	79%	0.786	S	S	*	*			cis	83.7	131.6	21.3	-60.1	-158.1	126.6	0	0	116.2
252	L	31.4	Very low	38.8	Very low	141 Å²	141	134.8 Å²	134.8	74%	0.738	78%	0.782	S	S	*	*			cis	-152.3	-174	3.9	-121.2	169.8	0	0	0	113.8
253	S	33.8	Very low	37.4	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	78%	0.784	S	S	*	*			trans	-109.8	173.5	-152.5	-55.7	0	0	0	0	116.6
254	P	52.9	Low	37	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	78%	0.779	S	S	*	*			trans	-101.7	-159.6	178.3	41.9	-35	0	0	0	112.5
255	P	57.2	Low	36.6	Very low	117 Å²	117	137.5 Å²	137.5	76%	0.76	77%	0.771	S	S	*	*			cis	-117.8	-132.3	-46.3	27.9	-5	0	0	0	110.7
256	P	65	Low	35.8	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	77%	0.772	S	S	*	*				-112.5	164.7	-78.7	35.8	-22.9	0	0	0	115.6
257	A	27	Very low	36	Very low	101 Å²	101	133.6 Å²	133.6	84%	0.835	77%	0.769	S	S	*	*			trans	-164.1	170.8	162.7	0	0	0	0	0	114.3
258	L	30.7	Very low	35.9	Very low	173 Å²	173	134.3 Å²	134.3	91%	0.906	77%	0.769	S	S	*	*			trans	-102.2	-149	179.6	-61	166.5	0	0	0	112.9
259	P	65.6	Low	36.3	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	76%	0.763	S	S	*	*				-121	-169.6	-127.8	35.8	-12.9	0	0	0	114.5
260	P	44.1	Very low	36.4	Very low	122 Å²	122	130.1 Å²	130.1	79%	0.792	76%	0.762	S	S	*	*				-147	154.3	122.2	35.5	-19.3	0	0	0	118.7
261	K	27.2	Very low	36.7	Very low	193 Å²	193	131.5 Å²	131.5	84%	0.839	76%	0.764	S	S	*	*			trans	-21.1	155.7	151.1	-62.9	158.4	-179.8	168.5	0	115.5
262	K	27.8	Very low	36.5	Very low	180 Å²	180	130.6 Å²	130.6	78%	0.783	77%	0.769	S	S	*	*			cis	-178.8	150.2	47.7	-145	170.9	-172.6	175.7	0	112.3
263	R	28.4	Very low	36.3	Very low	212 Å²	212	128.3 Å²	128.3	80%	0.8	77%	0.771	S	S	*	*			trans	65.7	148.8	165.7	-68	179.6	162.3	-171.6	-7.2	116
264	Q	28.4	Very low	35.7	Very low	149 Å²	149	129.3 Å²	129.3	70%	0.696	77%	0.772	S	S	*	*			cis	-163.3	170.6	-7	-118.1	171.1	-119.8	0	0	107.9
265	S	26.7	Very low	34.5	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	78%	0.775	S	S	*	*			cis	-154.6	180	-0.8	54.4	0	0	0	0	110.8
266	A	29.6	Very low	33.2	Very low	88 Å²	88	128.5 Å²	128.5	73%	0.727	77%	0.771	S	S	*	*			trans	-77.5	175.6	169.5	0	0	0	0	0	111.9
267	P	32.5	Very low	31.6	Very low	122 Å²	122	127.8 Å²	127.8	79%	0.792	77%	0.766	S	S	*	*			cis	-135.5	178	47.2	41.8	-24.5	0	0	0	117.6
268	S	28.7	Very low	31.4	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	77%	0.767	S	S	*	*			trans	-75.4	-170.6	165.7	58.4	0	0	0	0	111.6
269	P	36.6	Very low	31	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	75%	0.753	S	S	*	*			cis	-144.1	-176.1	8.5	40.3	-17.8	0	0	0	117.8
270	T	33.4	Very low	29.1	Very low	126 Å²	126	133.6 Å²	133.6	77%	0.773	76%	0.762	S	S	*	*			trans	-57.2	164.9	148.7	28.1	0	0	0	0	111.4
271	P	34.6	Very low	28.3	Very low	110 Å²	110	131.1 Å²	131.1	71%	0.714	76%	0.759	S	S	*	*			cis	-152.8	-176.9	37.5	45.1	-24.1	0	0	0	118.4
272	V	25.1	Very low	28.3	Very low	138 Å²	138	127.5 Å²	127.5	84%	0.836	76%	0.758	S	S	*	*			trans	58.7	149.2	140	165.9	0	0	0	0	121.8
273	A	26.1	Very low	28.3	Very low	93 Å²	93	123.3 Å²	123.3	77%	0.769	75%	0.752	S	S	*	*			trans	-87.1	-145.9	-172.5	0	0	0	0	0	115.1
274	V	22.5	Very low	28.4	Very low	125 Å²	125	120.2 Å²	120.2	76%	0.758	75%	0.75	S	S	*	*			trans	98	79.4	173.9	-168.2	0	0	0	0	116.6
275	V	26.7	Very low	29	Very low	135 Å²	135	118.8 Å²	118.8	82%	0.818	75%	0.754	S	S	*	*				62.8	143.7	112.9	172.1	0	0	0	0	121
276	A	30.2	Very low	28.8	Very low	81 Å²	81	118.9 Å²	118.9	67%	0.669	75%	0.753	S	S	*	*			trans	77.7	162.9	153.1	0	0	0	0	0	120
277	P	32.5	Very low	28.6	Very low	107 Å²	107	119.5 Å²	119.5	70%	0.695	75%	0.752	S	S	*	*			cis	-141.5	-175.3	-22.7	29.9	-7.3	0	0	0	115.8
278	M	21.1	Very low	28.2	Very low	171 Å²	171	119.6 Å²	119.6	84%	0.842	75%	0.746	S	S	*	*			trans	75.1	157.2	158.4	-35.5	-169	86.2	0	0	116.6
279	S	23.2	Very low	28	Very low	88 Å²	88	122.2 Å²	122.2	62%	0.615	75%	0.747	S	S	*	*			cis	-156.8	142.5	24.6	-59.5	0	0	0	0	115.3
280	R	25	Very low	27.4	Very low	250 Å²	250	125.9 Å²	125.9	94%	0.943	75%	0.746	S	S	*	*			trans	61.2	156.8	148	-60.8	164.6	-176	-175.6	-0.3	117.1
281	G	27	Very low	26.8	Very low	70 Å²	70	125.5 Å²	125.5	72%	0.722	74%	0.735	S	S	*	*			cis	-166.9	-172.4	-4.7	0	0	0	0	0	106.7
282	S	28.9	Very low	26.2	Very low	118 Å²	118	127.2 Å²	127.2	83%	0.825	73%	0.734	S	S	*	*			cis	-179	157.1	6.6	35.3	0	0	0	0	106.2
283	S	26.9	Very low	26	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	74%	0.735	S	S	*	*			cis	-173.2	140.6	6	34.7	0	0	0	0	112.2
284	L	29.7	Very low	25.8	Very low	147 Å²	147	134.3 Å²	134.3	77%	0.77	73%	0.734	S	S	*	*			trans	68.3	152.2	136.3	-63.1	172.6	0	0	0	118.9
285	P	41.9	Very low	25.8	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	73%	0.732	S	S	*	*			cis	-102.1	-120.4	16.1	39.7	-33.5	0	0	0	116.8
286	C	23.5	Very low	25.6	Very low	103 Å²	103	136 Å²	136	70%	0.696	73%	0.725	S	S	*	*				-164.8	177.9	-128	-73.3	0	0	0	0	110.2
287	S	24.4	Very low	25.1	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	72%	0.722	S	S	*	*			cis	171.7	174.3	-27.4	73.3	0	0	0	0	106.4
288	D	23.4	Very low	24.7	Very low	124 Å²	124	142 Å²	142	66%	0.663	73%	0.725	S	S	*	*			cis	-161.4	-171.7	-4.8	-149	-81.2	0	0	0	108.9
289	H	25.1	Very low	24.8	Very low	157 Å²	157	140.3 Å²	140.3	73%	0.727	72%	0.716	S	S	*	*			trans	73.2	150.8	156.4	-63.2	-2.8	0	0	0	118.7
290	R	24.4	Very low	25	Very low	189 Å²	189	146.3 Å²	146.3	71%	0.713	73%	0.725	S	S	*	*			cis	-160.1	145.8	-11.5	-119.4	174.4	76.4	-177	2.4	111.4
291	Q	21.4	Very low	24.9	Very low	118 Å²	118	146 Å²	146	55%	0.551	72%	0.724	S	S	*	*			trans	55.6	149.5	140.3	-94.2	179.7	-50.2	0	0	125.9
292	E	20.5	Very low	25.2	Very low	146 Å²	146	152.3 Å²	152.3	68%	0.682	73%	0.731	S	S	*	*			trans	75	110.1	139.3	-76	160.3	173	0	0	122.9
293	Y	21.9	Very low	25	Very low	221 Å²	221	152.6 Å²	152.6	87%	0.867	73%	0.733	S	S	*	*				44.6	157	117.6	-113.4	-98.6	0	0	0	123.4
294	E	22.2	Very low	25	Very low	160 Å²	160	152 Å²	152	75%	0.748	74%	0.743	S	S	*	*			trans	81.5	108	168.1	-62.6	-163.2	155	0	0	120.4
295	Q	21.1	Very low	24.8	Very low	151 Å²	151	148.3 Å²	148.3	71%	0.706	74%	0.74	S	S	*	*				77.1	96.2	114.1	-157	164	9	0	0	121.2
296	E	23.1	Very low	24.1	Very low	144 Å²	144	148.1 Å²	148.1	67%	0.673	74%	0.741	S	S	*	*				59.4	144.4	116.8	-140.6	178	-143.8	0	0	122.8
297	F	21.1	Very low	24.4	Very low	139 Å²	139	151.8 Å²	151.8	61%	0.61	75%	0.748	S	S	*	*			trans	86.2	119.2	157.8	-84	-61.5	0	0	0	123.2
298	F	22.7	Very low	24.7	Very low	174 Å²	174	151.3 Å²	151.3	76%	0.763	75%	0.745	S	S	*	*			trans	68.6	150.6	154	-61.9	-53	0	0	0	117.6
299	Q	23.6	Very low	24.8	Very low	137 Å²	137	156.4 Å²	156.4	64%	0.64	76%	0.756	S	S	*	*			cis	-157.9	163.2	17.7	-147.2	177.1	59.1	0	0	112.8
300	R	26.8	Very low	24.9	Very low	214 Å²	214	152.6 Å²	152.6	81%	0.808	76%	0.76	S	S	*	*			trans	66.9	115.5	170.2	-71.8	169.5	-103.4	174	-3	115.6
301	R	24.5	Very low	25	Very low	243 Å²	243	147 Å²	147	92%	0.917	76%	0.761	S	S	*	*			cis	86.8	126.8	31.1	-162	-166.5	-123.7	-169	2.1	114.4
302	F	31.8	Very low	25.2	Very low	202 Å²	202	149.2 Å²	149.2	89%	0.886	78%	0.776	S	S	*	*			trans	-58.2	147	172.5	-70.8	-100.5	0	0	0	115.1
303	S	25	Very low	25.7	Very low	124 Å²	124	147.8 Å²	147.8	87%	0.867	78%	0.782	S	S	*	*			trans	-170.8	149.6	141	-89	0	0	0	0	105.9
304	G	26.1	Very low	26.5	Very low	81 Å²	81	143.2 Å²	143.2	84%	0.835	78%	0.78	S	S	*	*			cis	90.1	130	39.2	0	0	0	0	0	109.2
305	G	26.4	Very low	26.9	Very low	69 Å²	69	147 Å²	147	71%	0.711	79%	0.787	S	S	*	*			cis	156.1	155.2	0.9	0	0	0	0	0	110.3
306	S	28	Very low	27.3	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	80%	0.798	S	S	*	*			trans	-169.2	131.3	167.1	-78	0	0	0	0	109.1
307	H	29	Very low	27.6	Very low	179 Å²	179	145.8 Å²	145.8	83%	0.829	80%	0.796	S	S	*	*				75.6	130.9	50.5	-64.1	-52.4	0	0	0	112.8
308	S	29.6	Very low	28.6	Very low	92 Å²	92	145.3 Å²	145.3	64%	0.643	81%	0.807	S	S	*	*			cis	-160.5	178.4	1.4	-162.8	0	0	0	0	112.5
309	Y	26.6	Very low	28.8	Very low	230 Å²	230	142.5 Å²	142.5	90%	0.902	81%	0.808	S	S	*	*			trans	68.9	146	177	-59.9	-88.9	0	0	0	116.7
310	G	27.2	Very low	28.9	Very low	78 Å²	78	141.9 Å²	141.9	80%	0.804	82%	0.818	S	S	*	*			cis	146	133.9	-10.1	0	0	0	0	0	113.3
311	G	27.1	Very low	28.9	Very low	71 Å²	71	137.2 Å²	137.2	73%	0.732	82%	0.819	S	S	*	*			trans	134	111.5	167.4	0	0	0	0	0	117
312	D	25.2	Very low	29	Very low	165 Å²	165	133.1 Å²	133.1	88%	0.882	81%	0.812	S	S	*	*			trans	35.4	141.5	140.7	-55	-35.9	0	0	0	124.5
313	S	31.6	Very low	28.8	Very low	116 Å²	116	127 Å²	127	81%	0.811	81%	0.806	S	S	*	*			trans	-80.6	161.7	160.1	-44.7	0	0	0	0	112
314	P	37.1	Very low	29.1	Very low	125 Å²	125	129.2 Å²	129.2	81%	0.812	80%	0.8	S	S	*	*			trans	-116	135.6	143.9	34.5	-28	0	0	0	112.3
315	R	32.2	Very low	29.2	Very low	240 Å²	240	133.3 Å²	133.3	91%	0.906	80%	0.802	S	S	*	*			trans	-72.9	153.2	159.6	-56.3	170.5	177.6	175.2	-2.5	108.7
316	L	28.2	Very low	29.2	Very low	177 Å²	177	134.3 Å²	134.3	93%	0.927	80%	0.798	S	S	*	*				-158.2	125.2	129.9	-98.1	-172.1	0	0	0	110.4
317	S	30	Very low	29.3	Very low	92 Å²	92	137.8 Å²	137.8	64%	0.643	80%	0.799	S	S	*	*			trans	-94.5	172.9	152.3	57.8	0	0	0	0	108.5
318	P	40.9	Very low	29.4	Very low	128 Å²	128	133.7 Å²	133.7	83%	0.831	79%	0.79	S	S	*	*				-143.5	159.7	92.4	36.8	-21.8	0	0	0	115.1
319	C	27.3	Very low	29.4	Very low	116 Å²	116	136.2 Å²	136.2	78%	0.784	80%	0.796	S	S	*	*			trans	-90.4	157.8	173	-45.5	0	0	0	0	111.6
320	S	26.7	Very low	29.6	Very low	123 Å²	123	133.1 Å²	133.1	86%	0.86	79%	0.79	S	S	*	*			trans	174.4	154.5	141	41.8	0	0	0	0	110.4
321	S	25.5	Very low	29.8	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	79%	0.789	S	S	*	*			cis	-140	161.5	-3.2	-166.5	0	0	0	0	111.4
322	M	27.5	Very low	29.9	Very low	156 Å²	156	141.4 Å²	141.4	77%	0.768	79%	0.793	S	S	*	*			trans	-88.4	161.2	168.3	-60.3	-176.6	-66.7	0	0	112.4
323	G	27.3	Very low	30	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	79%	0.785	S	S	*	*			trans	-166.1	86.6	153.1	0	0	0	0	0	109.5
324	K	30.6	Very low	29.9	Very low	170 Å²	170	137.9 Å²	137.9	74%	0.739	78%	0.782	S	S	*	*				71.3	147.1	74.3	-78	-81.7	-173.7	176.7	0	114.1
325	L	28.8	Very low	29.5	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	78%	0.783	S	S	*	*			trans	84.9	142.9	178.7	-50.6	178.5	0	0	0	115.2
326	S	27.5	Very low	29.4	Very low	90 Å²	90	134 Å²	134	63%	0.629	77%	0.769	S	S	*	*			cis	-170.3	121	-20.2	170	0	0	0	0	113.2
327	K	28.4	Very low	29.6	Very low	186 Å²	186	133.8 Å²	133.8	81%	0.809	76%	0.763	S	S	*	*			trans	61.3	150	151.3	-64.2	-179.5	172.3	-169.1	0	121.9
328	S	32.2	Very low	29.6	Very low	93 Å²	93	136 Å²	136	65%	0.65	77%	0.767	S	S	*	*			trans	62.3	143.7	139	55.2	0	0	0	0	120.9
329	D	29.1	Very low	29.1	Very low	145 Å²	145	135 Å²	135	78%	0.775	76%	0.764	S	S	*	*			cis	-161.6	174	-11	-103.1	-34.9	0	0	0	110.5
330	E	31.4	Very low	29.2	Very low	166 Å²	166	132.7 Å²	132.7	78%	0.776	76%	0.76	S	S	*	*			trans	24	115.4	152.6	-63.8	-172.3	139.2	0	0	120.2
331	Q	30.6	Very low	29.3	Very low	164 Å²	164	135.8 Å²	135.8	77%	0.766	76%	0.761	S	S	*	*				107.3	160.2	69.1	-88.6	-153	5.8	0	0	113.3
332	L	29.1	Very low	29.4	Very low	159 Å²	159	135.8 Å²	135.8	83%	0.832	76%	0.759	S	S	*	*			trans	77.6	178.5	168.5	-51.9	-170.6	0	0	0	118.5
333	S	28.6	Very low	29.5	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	76%	0.761	S	S	*	*			trans	-143.4	154.1	-131.9	57.1	0	0	0	0	116.6
334	S	29.7	Very low	29.6	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	76%	0.762	S	S	*	*			trans	55	125.8	146.7	63.9	0	0	0	0	121.9
335	M	27.7	Very low	29.4	Very low	171 Å²	171	138.6 Å²	138.6	84%	0.842	76%	0.762	S	S	*	*			trans	100.4	119	139.6	-146.3	164.6	77.5	0	0	120.1
336	D	30.8	Very low	29.4	Very low	113 Å²	113	137.8 Å²	137.8	60%	0.604	76%	0.763	S	S	*	*			trans	50.5	123.3	153.6	-77	-67.9	0	0	0	125.4
337	Q	31.8	Very low	29.5	Very low	171 Å²	171	138.4 Å²	138.4	80%	0.799	77%	0.768	S	S	*	*			trans	65.1	151.6	137.6	-63	172.1	49.6	0	0	118.5
338	D	30.5	Very low	29.5	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	76%	0.764	S	S	*	*			cis	-155	173.6	10.5	-177.2	32.9	0	0	0	111.3
339	S	30.8	Very low	29.3	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	77%	0.772	S	S	*	*			trans	69.5	148.8	161.4	-72.7	0	0	0	0	119.1
340	G	28.9	Very low	29.3	Very low	68 Å²	68	137.2 Å²	137.2	70%	0.701	77%	0.769	S	S	*	*			cis	165.9	171.1	-8.6	0	0	0	0	0	114.7
341	Q	28.4	Very low	29.1	Very low	188 Å²	188	137.1 Å²	137.1	88%	0.879	77%	0.773	S	S	*	*			trans	94.9	133.5	169	-53.8	-162.1	21.5	0	0	121.9
342	C	27.6	Very low	29	Very low	117 Å²	117	135.9 Å²	135.9	79%	0.791	77%	0.772	S	S	*	*			trans	29.1	148.2	137.6	-56.6	0	0	0	0	121.8
343	S	28.8	Very low	28.9	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	77%	0.766	S	S	*	*			cis	-162.5	171	41.8	-164.2	0	0	0	0	116.2
344	R	30.1	Very low	28.9	Very low	208 Å²	208	135.6 Å²	135.6	79%	0.785	77%	0.768	S	S	*	*			trans	-50.7	149.4	-179.9	-77.8	173.6	136	114	-6	119.3
345	N	26.8	Very low	28.9	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	77%	0.773	S	S	*	*			trans	49	126.6	130.6	-52.5	20.2	0	0	0	121.9
346	T	29.5	Very low	29	Very low	150 Å²	150	137 Å²	137	92%	0.92	77%	0.774	S	S	*	*				-154.1	179.6	123.7	6.9	0	0	0	0	110.4
347	S	28.7	Very low	28.9	Very low	104 Å²	104	142.2 Å²	142.2	73%	0.727	79%	0.787	S	S	*	*			trans	-156.2	153.3	-155.3	56.3	0	0	0	0	116.8
348	C	27.7	Very low	29	Very low	107 Å²	107	140.8 Å²	140.8	72%	0.723	78%	0.784	S	S	*	*			trans	78.8	148	156.6	-62.1	0	0	0	0	120.8
349	E	27.9	Very low	29.1	Very low	176 Å²	176	138.9 Å²	138.9	82%	0.822	78%	0.78	S	S	*	*			trans	66.1	148.1	151.3	-71.3	161.9	-147.2	0	0	119.6
350	T	29.4	Very low	29	Very low	116 Å²	116	141.3 Å²	141.3	71%	0.712	78%	0.784	S	S	*	*			cis	-175.4	139.5	-46	17.7	0	0	0	0	108.1
351	L	28.5	Very low	29.1	Very low	163 Å²	163	149 Å²	149	85%	0.853	79%	0.793	S	S	*	*			trans	66.5	147.8	176.8	-51.9	172.5	0	0	0	113.3
352	D	26.9	Very low	29.2	Very low	138 Å²	138	147.4 Å²	147.4	74%	0.738	79%	0.791	S	S	*	*			cis	-145.6	-171.1	34	-139.7	-46.8	0	0	0	113.5
353	N	28.8	Very low	29.2	Very low	134 Å²	134	151.2 Å²	151.2	72%	0.717	80%	0.795	S	S	*	*			trans	-68.8	171.2	-175.3	-61.9	-88.6	0	0	0	113.9
354	T	28	Very low	29.1	Very low	119 Å²	119	152.5 Å²	152.5	73%	0.73	79%	0.792	S	S	*	*			cis	-165.1	170.1	30.2	-30.9	0	0	0	0	111.8
355	E	29.2	Very low	29.1	Very low	186 Å²	186	151.9 Å²	151.9	87%	0.869	80%	0.798	S	S	*	*			trans	71.9	144.6	166	-59.3	178.4	-168.4	0	0	117.2
356	S	30.8	Very low	29.1	Very low	122 Å²	122	154.8 Å²	154.8	85%	0.853	81%	0.807	S	S	*	*			cis	-133	160.8	1.6	-170.6	0	0	0	0	111.3
357	Y	29.1	Very low	29	Very low	223 Å²	223	154.7 Å²	154.7	88%	0.875	80%	0.8	S	S	*	*			trans	-120.2	156	-166.5	-165.3	-93.5	0	0	0	113.1
358	D	33.1	Very low	28.9	Very low	140 Å²	140	157.3 Å²	157.3	75%	0.749	81%	0.805	S	S	*	*			trans	-86.5	130.3	-171.8	-161.2	22.9	0	0	0	112.1
359	P	31.5	Very low	28.9	Very low	99 Å²	99	158 Å²	158	64%	0.643	81%	0.812	S	S	*	*			trans	-91	179	-174.4	36	-36.5	0	0	0	115.2
360	D	30.1	Very low	29	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	82%	0.816	S	S	*	*			trans	72	41.9	166.8	-62.4	-3.9	0	0	0	118.3
361	Y	30.4	Very low	28.9	Very low	228 Å²	228	153 Å²	153	89%	0.894	82%	0.819	S	S	*	*			trans	-122.5	79.8	150.7	-118.1	-79.7	0	0	0	111.1
362	D	29.7	Very low	28.8	Very low	156 Å²	156	152.4 Å²	152.4	83%	0.834	82%	0.817	S	S	*	*			trans	173.4	125.9	141.3	-98.4	-19.1	0	0	0	111.7
363	F	28.5	Very low	28.7	Very low	196 Å²	196	153.2 Å²	153.2	86%	0.86	82%	0.822	S	S	*	*			trans	-155.1	140.3	153.9	-138.6	-108	0	0	0	110.9
364	L	27.6	Very low	28.8	Very low	144 Å²	144	154.5 Å²	154.5	75%	0.754	83%	0.828	S	S	*	*			trans	73	64.8	177.1	-48.8	-174.7	0	0	0	118.2
365	H	28.9	Very low	28.9	Very low	195 Å²	195	154.9 Å²	154.9	90%	0.903	83%	0.832	S	S	*	*			trans	-134.8	83.1	143.1	-99.1	-61.7	0	0	0	111.9
366	Q	27.4	Very low	28.6	Very low	195 Å²	195	150.4 Å²	150.4	91%	0.911	83%	0.827	S	S	*	*			trans	-168.3	120.7	149.8	-113.9	169.3	25.5	0	0	110.7
367	D	27.8	Very low	28.3	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	82%	0.822	S	S	*	*				-157.7	156.6	129.6	-140.1	-26	0	0	0	111.1
368	L	26.6	Very low	28.1	Very low	159 Å²	159	148.1 Å²	148.1	83%	0.832	82%	0.819	S	S	*	*			trans	57.4	97.4	169.1	-54	-177.2	0	0	0	119.6
369	S	27.8	Very low	27.7	Very low	122 Å²	122	148.3 Å²	148.3	85%	0.853	83%	0.825	S	S	*	*			trans	-143	99.9	146	64	0	0	0	0	111.7
370	A	29.7	Very low	27.5	Very low	110 Å²	110	147.1 Å²	147.1	91%	0.909	83%	0.831	S	S	*	*			trans	-161.6	130.3	170	0	0	0	0	0	109.6
371	G	26	Very low	27.3	Very low	76 Å²	76	143.1 Å²	143.1	78%	0.784	83%	0.827	S	S	*	*			trans	135.4	87	176.1	0	0	0	0	0	114
372	D	26.4	Very low	27.2	Very low	152 Å²	152	138.4 Å²	138.4	81%	0.813	83%	0.826	S	S	*	*			trans	-64.2	153.2	173.4	-57.2	-91.7	0	0	0	113.1
373	N	25	Very low	27.1	Very low	155 Å²	155	139 Å²	139	83%	0.829	83%	0.828	S	S	*	*				-175.5	141.2	114.7	-102.2	-79.9	0	0	0	112.3
374	L	32	Very low	27.3	Very low	161 Å²	161	135 Å²	135	84%	0.843	82%	0.824	S	S	*	*			trans	-127.5	139.6	163.6	-79	172.1	0	0	0	106.7
375	P	28.7	Very low	27.9	Very low	126 Å²	126	134 Å²	134	82%	0.818	83%	0.827	S	S	*	*				-146.6	174.2	85.5	38.5	-21.6	0	0	0	115.2
376	A	24.3	Very low	27.9	Very low	93 Å²	93	132.2 Å²	132.2	77%	0.769	82%	0.823	S	S	*	*			trans	-97.1	159.2	170.7	0	0	0	0	0	111.9
377	V	24.9	Very low	28.8	Very low	125 Å²	125	126.7 Å²	126.7	76%	0.758	80%	0.804	S	S	*	*			trans	-176.6	119	142	137.9	0	0	0	0	114
378	Q	23.2	Very low	28.7	Very low	171 Å²	171	123.7 Å²	123.7	80%	0.799	79%	0.785	S	S	*	*			trans	64.8	152.2	143.3	-60.3	178.7	-6.6	0	0	125.8
379	V	25.6	Very low	28.8	Very low	145 Å²	145	120.2 Å²	120.2	88%	0.879	77%	0.774	S	S	*	*			trans	74.4	126.1	164.2	-157.8	0	0	0	0	118.2
380	G	27.1	Very low	28.7	Very low	74 Å²	74	119.6 Å²	119.6	76%	0.763	76%	0.758	S	S	*	*			cis	160.7	137.4	-14.5	0	0	0	0	0	116.7
381	G	26.7	Very low	28.6	Very low	74 Å²	74	118.3 Å²	118.3	76%	0.763	74%	0.742	S	S	*	*			trans	101.6	159	163.5	0	0	0	0	0	117
382	C	27.8	Very low	28.5	Very low	130 Å²	130	123.3 Å²	123.3	88%	0.878	75%	0.745	S	S	*	*			cis	-159.8	161.3	-17.7	-121.3	0	0	0	0	113.4
383	L	27.9	Very low	28.5	Very low	167 Å²	167	120.5 Å²	120.5	87%	0.874	74%	0.737	S	S	*	*			trans	-41.4	168.2	-173	-57.5	168.9	0	0	0	121.8
384	S	31.1	Very low	28.5	Very low	112 Å²	112	118.7 Å²	118.7	78%	0.783	74%	0.736	S	S	*	*			trans	-62.9	168.8	176.2	-27.7	0	0	0	0	115.8
385	P	41.7	Very low	28.5	Very low	125 Å²	125	115.5 Å²	115.5	81%	0.812	73%	0.727	S	S	*	*				-157.1	-164.9	76.9	42.7	-20.3	0	0	0	117.8
386	L	28.9	Very low	29.1	Very low	157 Å²	157	115.2 Å²	115.2	82%	0.822	73%	0.726	S	S	*	*			trans	-75.9	-178	167.5	-92.8	79.1	0	0	0	113
387	P	44.9	Very low	29.1	Very low	79 Å²	79	116.7 Å²	116.7	51%	0.513	73%	0.725	S	S	.	*			cis	-137.9	-161.7	-0.2	28	-1.4	0	0	0	116.2	S633	P387-S633 PolarHBondContact O-OG 2.75Å
388	E	26.4	Very low	30	Very low	85 Å²	85	116.8 Å²	116.8	40%	0.397	73%	0.728	S	S	.	*			trans	91.6	142.6	137.6	-127.3	-175.9	-131.5	0	0	119.1	N634 S635 Y636	E388-N634 CarbonylContact O-C 3.33Å; E388-N634 WeakPolarHBondContact O-CA 3.5Å; E388-N634 PolarHBondContact O-N 3.45Å; E388-S635 WeakPolarHBondContact OE2-CB 3.45Å; E388-S635 PolarHBondContact OE2-OG 2.97Å; E388-Y636 WeakPolarHBondContact OE2-CE1 3.35Å
389	S	27.8	Very low	30.1	Very low	86 Å²	86	111.8 Å²	111.8	60%	0.601	72%	0.723	S	S	*	*	B	Isolated β-bridge	trans	-159.6	126.4	-162.2	60.5	0	0	0	0	121	N634 S635	S389-N634 VanDerWaalsContact CA-C 3.4Å; S389-N634 WeakPolarHBondContact CA-O 3.49Å; S389-S635 VanDerWaalsContact C-C 3.47Å; S389-S635 CarbonylContact C-O 3.2Å; S389-S635 VanDerWaalsContact N-N 3.17Å
390	H	27	Very low	30.3	Very low	109 Å²	109	113 Å²	113	51%	0.505	72%	0.718	S	S	.	*			trans	-137.6	172.1	173.3	-106	28.2	0	0	0	113.9	N634 S635 Y636	H390-N634 PolarHBondContact N-O 2.81Å; H390-S635 WeakPolarHBondContact CB-O 3.42Å; H390-S635 PolarHBondContact N-O 2.89Å; H390-S635 PolarHBondContact ND1-O 2.99Å; H390-Y636 PolarHBondContact CE1-O 3.22Å; H390-Y636 VanDerWaalsContact CE1-O 3.28Å; H390-Y636 PolarHBondContact ND1-O 3.46Å
391	S	26.8	Very low	30.3	Very low	82 Å²	82	116.4 Å²	116.4	57%	0.573	71%	0.714	S	S	*	*			cis	106.8	127.2	8	133.3	0	0	0	0	119.2
392	E	24.9	Very low	30.2	Very low	182 Å²	182	120.2 Å²	120.2	85%	0.85	72%	0.717	S	S	*	*			trans	67.4	156.6	-173.6	-60.4	-158.5	140.8	0	0	119.3
393	S	25.5	Very low	30.2	Very low	92 Å²	92	118.5 Å²	118.5	64%	0.643	71%	0.712	S	S	*	*			cis	-166.8	171.2	-39.6	75.8	0	0	0	0	112
394	S	24.6	Very low	30.2	Very low	117 Å²	117	118.4 Å²	118.4	82%	0.818	71%	0.706	S	S	*	*			trans	70	167.9	159.9	-54.8	0	0	0	0	119.5
395	S	32.9	Very low	30.9	Very low	94 Å²	94	118.4 Å²	118.4	66%	0.657	70%	0.703	S	S	*	*			cis	173.3	136.3	-35.5	-172.2	0	0	0	0	108.4
396	P	40.1	Very low	30.8	Very low	120 Å²	120	117.4 Å²	117.4	78%	0.779	70%	0.697	S	S	*	*				-147.5	162.4	101.1	29.8	-8	0	0	0	114.4
397	V	25.7	Very low	30.6	Very low	125 Å²	125	117.8 Å²	117.8	76%	0.758	70%	0.699	S	S	*	*			cis	83.8	140.8	31.8	175.3	0	0	0	0	112.9
398	P	42.4	Very low	29.7	Very low	127 Å²	127	119.1 Å²	119.1	83%	0.825	71%	0.71	S	S	*	*			cis	-132.7	170.5	8	36.5	-17.5	0	0	0	119.5
399	G	26.5	Very low	29.9	Very low	66 Å²	66	119.9 Å²	119.9	68%	0.68	73%	0.731	S	S	*	*			trans	118.7	176.1	147.1	0	0	0	0	0	117.8
400	Q	29.6	Very low	30.3	Very low	169 Å²	169	121.5 Å²	121.5	79%	0.79	74%	0.74	S	S	*	*			cis	-170.4	159.4	-33.3	-84	-150.6	-38	0	0	107.7
401	H	26.5	Very low	31.4	Very low	146 Å²	146	122 Å²	122	68%	0.676	75%	0.752	S	S	*	*			cis	-168.8	136.2	-31.7	-92.7	-18.9	0	0	0	110.6
402	L	25.3	Very low	31.4	Very low	155 Å²	155	123.9 Å²	123.9	81%	0.812	77%	0.765	S	S	*	*			trans	65.6	151.3	160	-58.8	169.6	0	0	0	118.7
403	A	26.8	Very low	31.5	Very low	94 Å²	94	123.4 Å²	123.4	78%	0.777	76%	0.763	S	S	*	*			cis	-139.1	-168.3	13.2	0	0	0	0	0	114.9
404	H	28.2	Very low	31.4	Very low	165 Å²	165	127 Å²	127	76%	0.764	77%	0.77	S	S	*	*			trans	-124.3	-172	-157.3	-75.1	-75.8	0	0	0	113
405	P	45.4	Very low	31.4	Very low	111 Å²	111	128.2 Å²	128.2	72%	0.721	76%	0.763	S	S	*	*			cis	-131.4	-144.3	-40.8	36.3	-14.2	0	0	0	109.7
406	P	39.5	Very low	31	Very low	104 Å²	104	131 Å²	131	68%	0.675	77%	0.765	S	S	*	*			cis	-139.5	176.3	-12.9	42.1	-23.3	0	0	0	119.2
407	L	25.8	Very low	30.4	Very low	166 Å²	166	133.9 Å²	133.9	87%	0.869	76%	0.762	S	S	*	*			trans	80.4	168	148.7	-81	160.6	0	0	0	121.2
408	S	26.4	Very low	30.2	Very low	107 Å²	107	139.3 Å²	139.3	75%	0.748	77%	0.769	S	S	*	*			trans	-155.1	148.3	-146.4	-48.6	0	0	0	0	115.5
409	A	29.3	Very low	29.5	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	75%	0.752	S	S	*	*			trans	63.7	172.3	168.2	0	0	0	0	0	115.6
410	P	36.9	Very low	29.9	Very low	121 Å²	121	139.8 Å²	139.8	79%	0.786	76%	0.759	S	S	*	*			cis	-127.7	-164.1	3.9	45.7	-27.9	0	0	0	113.5
411	P	50.7	Low	29.6	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	76%	0.76	S	S	*	*			trans	-110.4	-172.1	-170.8	41.9	-34.2	0	0	0	116
412	S	25.4	Very low	30.4	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	76%	0.762	S	S	*	*			trans	113.6	-175.8	167	76.4	0	0	0	0	117.4
413	Q	27.8	Very low	30.4	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	76%	0.759	S	S	*	*			trans	-113.6	163.8	-142.8	-56.1	171.7	-69.5	0	0	116.5
414	Q	23.7	Very low	30.3	Very low	167 Å²	167	141.5 Å²	141.5	78%	0.78	76%	0.761	S	S	*	*			trans	67.2	156.9	162	-70.9	-175.5	-74.9	0	0	117.7
415	Q	24.6	Very low	30.1	Very low	143 Å²	143	139 Å²	139	67%	0.668	76%	0.762	S	S	*	*			cis	-169	171.7	-26	-171.9	173.4	-42.4	0	0	107.8
416	E	25.3	Very low	29	Very low	153 Å²	153	141 Å²	141	72%	0.715	77%	0.767	S	S	*	*			trans	75.8	151.4	164.7	-53.1	-152.6	146.2	0	0	117.9
417	Y	27	Very low	29.1	Very low	180 Å²	180	141.2 Å²	141.2	71%	0.706	77%	0.768	S	S	*	*			cis	-162.1	148.4	-21.3	-132.8	-81	0	0	0	109.3
418	W	21.4	Very low	29	Very low	239 Å²	239	140.6 Å²	140.6	91%	0.905	77%	0.765	S	S	*	*				-173.5	167.9	128.2	-118.5	74.9	0	0	0	114.3
419	T	27.8	Very low	28.9	Very low	76 Å²	76	143.8 Å²	143.8	47%	0.466	77%	0.768	S	S	.	*			trans	-128.2	168.5	-157.7	-13.2	0	0	0	0	112.1
420	P	34.8	Very low	28.7	Very low	127 Å²	127	144.1 Å²	144.1	83%	0.825	76%	0.764	S	S	*	*				-143.2	176.9	76	31.6	-9	0	0	0	117
421	Q	22.3	Very low	28.2	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.822	76%	0.763	S	S	*	*			trans	-105.9	179.6	-169.5	-104.5	-172.5	-13.3	0	0	113.2
422	P	44.6	Very low	27	Very low	109 Å²	109	149 Å²	149	71%	0.708	77%	0.767	S	S	*	*			cis	-124	-154.3	17.1	35.1	-11.5	0	0	0	112.9
423	N	24	Very low	26.9	Very low	141 Å²	141	148.7 Å²	148.7	75%	0.754	76%	0.76	S	S	*	*			cis	-158.2	-175.4	13	-156.3	9.2	0	0	0	114.5
424	Q	25.8	Very low	26.8	Very low	175 Å²	175	145.7 Å²	145.7	82%	0.818	76%	0.759	S	S	*	*			trans	-81.1	166.6	175.3	-50.8	168.4	0.2	0	0	112
425	S	23.2	Very low	26.9	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	76%	0.756	S	S	*	*			cis	-156.6	177.4	12.6	60	0	0	0	0	113.7
426	N	23	Very low	28	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	76%	0.761	S	S	*	*			trans	-65.7	-178.8	170.1	-54.3	-20.6	0	0	0	113.2
427	P	40.9	Very low	28.9	Very low	109 Å²	109	139.4 Å²	139.4	71%	0.708	77%	0.765	S	S	*	*			cis	-140.6	-167.6	-0.3	43.9	-23.9	0	0	0	116.5
428	L	24.1	Very low	29	Very low	152 Å²	152	135.1 Å²	135.1	80%	0.796	77%	0.767	S	S	*	*			trans	47.2	143.3	146.2	-74.2	164.7	0	0	0	124.8
429	Q	24.3	Very low	29.1	Very low	175 Å²	175	131.3 Å²	131.3	82%	0.818	76%	0.763	S	S	*	*			trans	60.6	126.5	145.9	-77.1	-175.7	-7.1	0	0	123.7
430	S	25.1	Very low	29.5	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	77%	0.773	S	S	*	*				50.5	101	129.8	179.8	0	0	0	0	122.9
431	C	26.9	Very low	29.1	Very low	111 Å²	111	133 Å²	133	75%	0.75	77%	0.767	S	S	*	*				79.1	147.2	125.8	-158	0	0	0	0	122
432	R	24.4	Very low	29.4	Very low	230 Å²	230	132 Å²	132	87%	0.868	76%	0.761	S	S	*	*			trans	74.3	167.6	173.8	-43.9	-176.8	170.9	-167.7	-3.6	115.1
433	T	23.5	Very low	28.6	Very low	115 Å²	115	135.7 Å²	135.7	71%	0.706	77%	0.765	S	S	*	*			cis	-149.5	161.5	11.7	45.9	0	0	0	0	113.2
434	S	25.6	Very low	28.6	Very low	110 Å²	110	140.1 Å²	140.1	77%	0.769	77%	0.771	S	S	*	*			trans	62.6	154.9	139.1	62.4	0	0	0	0	122.3
435	A	26.5	Very low	28.7	Very low	87 Å²	87	142.6 Å²	142.6	72%	0.719	77%	0.773	S	S	*	*			cis	-166.9	-128	-19.5	0	0	0	0	0	110.9
436	P	46.5	Very low	28.9	Very low	119 Å²	119	142.2 Å²	142.2	77%	0.773	77%	0.77	S	S	*	*				-93.9	175.5	-108.3	38.4	-27.4	0	0	0	114.1
437	P	45.3	Very low	29	Very low	125 Å²	125	140.8 Å²	140.8	81%	0.812	77%	0.768	S	S	*	*			cis	-131.9	-156.3	33.1	35.7	-10.5	0	0	0	113.3
438	A	28.5	Very low	28.2	Very low	89 Å²	89	144 Å²	144	74%	0.736	77%	0.773	S	S	*	*			cis	-154.9	-146.8	15.4	0	0	0	0	0	114.9
439	L	23.9	Very low	28.2	Very low	159 Å²	159	144 Å²	144	83%	0.832	78%	0.78	S	S	*	*			trans	-145.2	167.6	-173.1	-73.8	176.9	0	0	0	108.9
440	P	36.2	Very low	28.2	Very low	102 Å²	102	140.8 Å²	140.8	66%	0.662	78%	0.776	S	S	*	*			cis	-149.8	142.5	26	36.7	-13	0	0	0	120.8
441	L	27.4	Very low	28.2	Very low	136 Å²	136	140.9 Å²	140.9	71%	0.712	78%	0.777	S	S	*	*			trans	68.4	159.6	136.6	-56.6	172.3	0	0	0	119.3
442	K	26.7	Very low	28.1	Very low	157 Å²	157	144.8 Å²	144.8	68%	0.683	78%	0.782	S	S	*	*			cis	-165	136.2	6.1	-128.8	159.8	-169.6	167.2	0	114
443	K	28.7	Very low	28.1	Very low	186 Å²	186	138 Å²	138	81%	0.809	77%	0.77	S	S	*	*			trans	62.3	165.5	147.1	-70.6	170.9	175.8	-172.7	0	122.2
444	R	25.1	Very low	28.2	Very low	233 Å²	233	139.9 Å²	139.9	88%	0.879	78%	0.775	S	S	*	*			cis	174.3	151.5	-36.4	-167.7	172.4	-171.4	-170.9	3.6	111.6
445	R	26.6	Very low	28.1	Very low	228 Å²	228	138.4 Å²	138.4	86%	0.86	78%	0.778	S	S	*	*			trans	94.5	120	160.8	-165.3	175.6	-90.2	-157.2	-8.5	114.8
446	S	26.8	Very low	28.1	Very low	104 Å²	104	138.5 Å²	138.5	73%	0.727	79%	0.787	S	S	*	*				76.3	141	63.6	-140.8	0	0	0	0	113.2
447	T	25.5	Very low	27.1	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	79%	0.787	S	S	*	*			cis	-150.7	172.3	37.8	40.5	0	0	0	0	116.6
448	Q	24.3	Very low	26.2	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	79%	0.794	S	S	*	*			trans	-56.6	167.2	170.7	-54.8	154.9	-58.7	0	0	117.8
449	T	25.1	Very low	26.1	Very low	151 Å²	151	145.7 Å²	145.7	93%	0.926	79%	0.793	S	S	*	*			trans	-154.5	165.9	138.2	20.5	0	0	0	0	111.5
450	S	24	Very low	26.2	Very low	107 Å²	107	144.9 Å²	144.9	75%	0.748	79%	0.789	S	S	*	*			trans	-165.4	146.6	-168.6	57.3	0	0	0	0	115.8
451	S	24.2	Very low	25.6	Very low	109 Å²	109	149.8 Å²	149.8	76%	0.762	80%	0.796	S	S	*	*			trans	-167.8	136.6	163.6	49.6	0	0	0	0	109.3
452	F	24.7	Very low	25.5	Very low	193 Å²	193	149.8 Å²	149.8	85%	0.846	79%	0.792	S	S	*	*			cis	67	135.4	43.6	-68.2	-65.8	0	0	0	113.9
453	S	25.6	Very low	25.4	Very low	89 Å²	89	152.3 Å²	152.3	62%	0.622	80%	0.798	S	S	*	*			cis	-163.4	173.2	-10.5	-158.7	0	0	0	0	110.5
454	D	24.2	Very low	25.4	Very low	154 Å²	154	153.8 Å²	153.8	82%	0.824	80%	0.799	S	S	*	*			trans	64.8	159.1	160	-65.3	24.8	0	0	0	118.2
455	G	25	Very low	25.7	Very low	79 Å²	79	148 Å²	148	81%	0.814	79%	0.792	S	S	*	*			cis	138.8	125.1	-8.2	0	0	0	0	0	114
456	G	25.3	Very low	25.8	Very low	88 Å²	88	141.4 Å²	141.4	91%	0.907	78%	0.781	S	S	*	*			trans	134.3	139.9	165.9	0	0	0	0	0	116.5
457	S	26	Very low	25.8	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	79%	0.789	S	S	*	*			trans	-123.4	143	173.3	173.3	0	0	0	0	110.6
458	R	27	Very low	25.9	Very low	252 Å²	252	149.3 Å²	149.3	95%	0.951	79%	0.791	S	S	*	*			trans	-161.3	166.1	165.3	-110.3	170.3	-165.7	-144.3	1.1	111.1
459	V	26.7	Very low	26.1	Very low	120 Å²	120	146.6 Å²	146.6	73%	0.727	78%	0.782	S	S	*	*			trans	-137.7	158.8	-154.8	-162.2	0	0	0	0	112.1
460	L	24.7	Very low	26.3	Very low	142 Å²	142	145.5 Å²	145.5	74%	0.743	77%	0.77	S	S	*	*			trans	111.2	110.8	152.4	-57.2	174.2	0	0	0	119.9
461	Y	23.8	Very low	26.4	Very low	205 Å²	205	148.2 Å²	148.2	80%	0.804	78%	0.776	S	S	*	*			trans	87.6	137.1	130.4	-91.7	-97.1	0	0	0	126.3
462	E	25.6	Very low	26.9	Very low	136 Å²	136	148.1 Å²	148.1	64%	0.636	78%	0.775	S	S	*	*			trans	68.2	150.2	158.1	-99.7	177.1	-127.3	0	0	119.3
463	R	24.3	Very low	26.9	Very low	211 Å²	211	148 Å²	148	80%	0.796	78%	0.777	S	S	*	*			cis	-154	161	17.5	-167.6	172.8	-78.3	167.5	-4.2	113.6
464	Y	28.5	Very low	27	Very low	216 Å²	216	151.3 Å²	151.3	85%	0.847	78%	0.782	S	S	*	*			trans	-75.8	158.1	168.8	-96	-83.6	0	0	0	114.1
465	P	31.8	Very low	27.1	Very low	111 Å²	111	151.3 Å²	151.3	72%	0.721	78%	0.777	S	S	*	*				-148.9	-174.5	100.3	37.6	-20.4	0	0	0	113.8
466	S	28.4	Very low	27.2	Very low	91 Å²	91	155.5 Å²	155.5	64%	0.636	78%	0.78	S	S	*	*				178.3	130	-51.6	62.8	0	0	0	0	109.6
467	Q	27.7	Very low	27.1	Very low	189 Å²	189	159.2 Å²	159.2	88%	0.883	77%	0.774	S	S	*	*			trans	-175.7	109.4	159.4	-106	159.6	7.3	0	0	108.2
468	Y	26.1	Very low	27.7	Very low	204 Å²	204	159.6 Å²	159.6	80%	0.8	77%	0.774	S	S	*	*				68.8	133.7	75.2	-86.1	-99.7	0	0	0	114.6
469	D	30.4	Very low	27.7	Very low	120 Å²	120	153.3 Å²	153.3	64%	0.642	76%	0.763	S	S	*	*			cis	-174	176.7	-21.8	-146.5	-24.3	0	0	0	111.4
470	N	28.9	Very low	29.1	Very low	127 Å²	127	152 Å²	152	68%	0.679	76%	0.758	S	S	*	*			trans	109.8	105.7	153.7	-58.1	-78.3	0	0	0	121.4
471	L	25.8	Very low	30.1	Very low	165 Å²	165	150.2 Å²	150.2	86%	0.864	75%	0.754	S	S	*	*				71.8	158.9	123	-59.6	177.9	0	0	0	123.2
472	S	33.9	Very low	30.4	Very low	106 Å²	106	149.2 Å²	149.2	74%	0.741	76%	0.755	S	S	*	*			trans	-154	146.2	-169.6	55.5	0	0	0	0	111.1
473	E	25.2	Very low	31.9	Very low	190 Å²	190	147.5 Å²	147.5	89%	0.888	76%	0.755	S	S	*	*			trans	169.1	167.8	165.8	-98.9	-178.4	163.2	0	0	106.6
474	E	27.7	Very low	32.1	Very low	159 Å²	159	144 Å²	144	74%	0.743	75%	0.751	S	S	*	*			cis	-163.7	-176.4	-39.7	-158.2	54.6	-157.9	0	0	107.7
475	E	27.1	Very low	32.2	Very low	154 Å²	154	142 Å²	142	72%	0.72	75%	0.748	S	S	*	*			trans	-44.1	155.3	-176.1	-56.7	178.6	118.4	0	0	119
476	L	25.4	Very low	32	Very low	167 Å²	167	141.6 Å²	141.6	87%	0.874	74%	0.743	S	S	*	*				-176.2	143.2	109.6	-97.3	162.9	0	0	0	116.1
477	H	23.5	Very low	32.7	Very low	167 Å²	167	143.1 Å²	143.1	77%	0.773	75%	0.751	S	S	*	*			trans	-81.4	-179.1	166.7	-79.1	-73.2	0	0	0	111
478	P	38.8	Very low	32.8	Very low	120 Å²	120	141.3 Å²	141.3	78%	0.779	75%	0.746	S	S	*	*			cis	-147	-173.5	20	43.8	-21.5	0	0	0	119.6
479	T	26.4	Very low	32.9	Very low	120 Å²	120	136.9 Å²	136.9	74%	0.736	74%	0.744	S	S	*	*			trans	-70.6	-169.3	168	54.1	0	0	0	0	113.6
480	P	56.4	Low	33.3	Very low	93 Å²	93	136.5 Å²	136.5	60%	0.604	75%	0.748	S	S	*	*			cis	-113.4	-100.1	-7.9	29	-6.5	0	0	0	113.8	F482	P480-F482 HydrophobicContact CG-CD2 4.1Å; P480-F482 HydrophobicContact CG-CE2 3.8Å
481	P	45.7	Very low	33.2	Very low	104 Å²	104	137.5 Å²	137.5	68%	0.675	75%	0.751	S	S	*	*			cis	-134.6	109.1	-2.5	35	-10.9	0	0	0	117.4
482	F	31.6	Very low	33.9	Very low	184 Å²	184	134.4 Å²	134.4	81%	0.807	74%	0.74	S	S	*	*			trans	60.8	171.9	136	-67.9	-62	0	0	0	123.1	P480	P480-F482 HydrophobicContact CG-CD2 4.1Å; P480-F482 HydrophobicContact CG-CE2 3.8Å
483	P	55.3	Low	34.2	Very low	100 Å²	100	136 Å²	136	65%	0.649	74%	0.736	S	S	*	*			cis	-123	162.1	-32.4	28.8	-10	0	0	0	112
484	L	29.7	Very low	34.7	Very low	137 Å²	137	130.6 Å²	130.6	72%	0.717	72%	0.716	S	S	*	*				-174.7	168.2	75.7	-79.8	168.9	0	0	0	108
485	F	29.4	Very low	35.1	Very low	175 Å²	175	129.1 Å²	129.1	77%	0.768	71%	0.714	S	S	*	*			cis	-145.6	-130	5.9	-141.8	-28.7	0	0	0	112.7
486	T	27.5	Very low	35	Very low	101 Å²	101	124.3 Å²	124.3	62%	0.62	71%	0.705	S	S	*	*			trans	-135.4	162.2	-171.6	44.9	0	0	0	0	110.6
487	P	45.2	Very low	35.1	Very low	123 Å²	123	119 Å²	119	80%	0.799	69%	0.691	S	S	*	*			cis	-130.1	-173.5	24.6	14.3	13.4	0	0	0	114.7
488	I	29.4	Very low	35	Very low	152 Å²	152	116.7 Å²	116.7	78%	0.779	69%	0.688	S	S	*	*			cis	-162.5	167	-40.7	-111.3	168.9	0	0	0	108.7
489	S	27.5	Very low	34.9	Very low	111 Å²	111	118.3 Å²	118.3	78%	0.776	68%	0.683	S	S	*	*			trans	-158.9	-174.3	179.2	-127.4	0	0	0	0	109.9
490	P	39.8	Very low	35.2	Very low	111 Å²	111	119.3 Å²	119.3	72%	0.721	69%	0.689	S	S	*	*			cis	-140.6	-170.5	10	43.1	-23.5	0	0	0	117.2
491	M	25.5	Very low	33.7	Very low	148 Å²	148	117.9 Å²	117.9	73%	0.729	68%	0.681	S	S	*	*			trans	75.3	170.7	153.1	-100.5	-143.2	151.2	0	0	119.2	Q493	M491-Q493 HydrophobicContact CE-CG 3.77Å; M491-Q493 HydrophobicContact SD-CG 3.94Å
492	P	41.5	Very low	32.9	Very low	100 Å²	100	115.2 Å²	115.2	65%	0.649	66%	0.66	S	S	*	*			cis	-127.7	156.4	12.8	47	-32.2	0	0	0	116.3
493	Q	38.7	Very low	32.9	Very low	141 Å²	141	112.2 Å²	112.2	66%	0.659	65%	0.646	S	S	*	*				68.2	155.8	109.5	-65.5	-172.4	19.1	0	0	118	M491	M491-Q493 HydrophobicContact CE-CG 3.77Å; M491-Q493 HydrophobicContact SD-CG 3.94Å
494	T	37.1	Very low	32.2	Very low	75 Å²	75	115.1 Å²	115.1	46%	0.46	65%	0.653	S	S	.	*			cis	-165.3	167.1	-3.5	16	0	0	0	0	111.2	F503	T494-F503 WeakPolarHBondContact O-CD1 3.08Å; T494-F503 WeakPolarHBondContact O-CE1 3.35Å
495	N	36.3	Very low	32.4	Very low	129 Å²	129	113.3 Å²	113.3	69%	0.69	66%	0.658	S	S	*	*			trans	51	133.2	145.1	-64.7	-6.7	0	0	0	122.7	Q502	N495-Q502 PolarHBondContact O-NE2 3.4Å; N495-Q502 PolarHBondContact O-OE1 3.41Å
496	G	24.8	Very low	32.5	Very low	52 Å²	52	109.9 Å²	109.9	54%	0.536	66%	0.655	S	S	.	*				87	175	128.3	0	0	0	0	0	117.6	Q502	G496-Q502 PolarHBondContact O-OE1 3.38Å
497	G	26.6	Very low	32.5	Very low	56 Å²	56	112.5 Å²	112.5	58%	0.577	66%	0.661	S	S	*	*	S	Bend	cis	113.6	-44.4	0	0	0	0	0	0	116.7	S501 Q502	G497-S501 VanDerWaalsContact C-CB 3.48Å; G497-S501 VanDerWaalsContact O-CB 3.3Å; G497-S501 WeakPolarHBondContact O-CB 3.43Å; G497-S501 PolarHBondContact O-OG 2.99Å; G497-Q502 VanDerWaalsContact N-OE1 3.16Å
498	V	22.4	Very low	31.7	Very low	118 Å²	118	113.1 Å²	113.1	72%	0.715	66%	0.657	S	S	*	*			trans	-137.6	91.5	-176	-172.1	0	0	0	0	112.5	S501 Q502	V498-S501 WeakPolarHBondContact CA-OG 3.49Å; V498-S501 PolarHBondContact N-OG 3.44Å; V498-Q502 WeakPolarHBondContact O-CG 3.42Å; V498-Q502 PolarHBondContact O-OE1 3.44Å
499	F	36.7	Very low	31.7	Very low	155 Å²	155	110.1 Å²	110.1	68%	0.68	66%	0.655	S	S	*	*	S	Bend	trans	-120.7	-78.4	135.4	104.3	78.3	0	0	0	104.5	S501 Q502	F499-S501 PolarHBondContact N-OG 3.45Å; F499-Q502 HydrophobicContact CB-CB 4.43Å; F499-Q502 HydrophobicContact CB-CG 4.2Å; F499-Q502 HydrophobicContact CD2-CB 4.48Å
500	V	31.8	Very low	31.7	Very low	140 Å²	140	112.8 Å²	112.8	85%	0.848	66%	0.661	S	S	*	*	S	Bend	trans	-145.1	22	146.4	-147.8	0	0	0	0	111
501	S	25.6	Very low	31.6	Very low	63 Å²	63	113.7 Å²	113.7	44%	0.441	66%	0.664	S	S	.	*	S	Bend	cis	-175.6	171.8	25.6	-70.5	0	0	0	0	112.1	G497 V498 F499	G497-S501 VanDerWaalsContact C-CB 3.48Å; G497-S501 VanDerWaalsContact O-CB 3.3Å; G497-S501 WeakPolarHBondContact O-CB 3.43Å; G497-S501 PolarHBondContact O-OG 2.99Å; V498-S501 WeakPolarHBondContact CA-OG 3.49Å; V498-S501 PolarHBondContact N-OG 3.44Å; F499-S501 PolarHBondContact N-OG 3.45Å
502	Q	27.6	Very low	32	Very low	49 Å²	49	112.5 Å²	112.5	23%	0.229	67%	0.667	C	S	.	*			cis	-170.5	146.9	-34.8	-164.8	-150.8	-18.9	0	0	112.3	N495 G496 G497 V498 F499	N495-Q502 PolarHBondContact O-NE2 3.4Å; N495-Q502 PolarHBondContact O-OE1 3.41Å; G496-Q502 PolarHBondContact O-OE1 3.38Å; G497-Q502 VanDerWaalsContact N-OE1 3.16Å; V498-Q502 WeakPolarHBondContact O-CG 3.42Å; V498-Q502 PolarHBondContact O-OE1 3.44Å; F499-Q502 HydrophobicContact CB-CB 4.43Å; F499-Q502 HydrophobicContact CB-CG 4.2Å; F499-Q502 HydrophobicContact CD2-CB 4.48Å
503	F	33.4	Very low	31.4	Very low	121 Å²	121	111.7 Å²	111.7	53%	0.531	67%	0.669	S	S	.	*			trans	58.8	109.6	149.7	-82.6	-147.5	0	0	0	127.5	T494	T494-F503 WeakPolarHBondContact O-CD1 3.08Å; T494-F503 WeakPolarHBondContact O-CE1 3.35Å
504	M	40	Very low	30.9	Very low	161 Å²	161	112.3 Å²	112.3	79%	0.793	68%	0.677	S	S	*	*				85.3	108.2	120.2	-60	-55.2	-176.6	0	0	128.8
505	A	34.2	Very low	30.9	Very low	98 Å²	98	114.3 Å²	114.3	81%	0.81	69%	0.691	S	S	*	*				93.9	117.1	117	0	0	0	0	0	129.1
506	S	30.7	Very low	30.7	Very low	103 Å²	103	113.9 Å²	113.9	72%	0.72	70%	0.695	S	S	*	*			trans	48.6	132.8	139.9	-114.4	0	0	0	0	131.8
507	E	27.5	Very low	31.1	Very low	156 Å²	156	117.3 Å²	117.3	73%	0.729	71%	0.708	S	S	*	*				79.9	134.6	126.4	-97.2	174.5	112.7	0	0	130.7
508	N	29.7	Very low	31.4	Very low	136 Å²	136	122 Å²	122	73%	0.727	72%	0.719	S	S	*	*			trans	91.4	131.5	138.3	-78.5	-42.7	0	0	0	127.6
509	A	28.2	Very low	32	Very low	89 Å²	89	122 Å²	122	74%	0.736	72%	0.722	S	S	*	*			trans	89.5	148	141.1	0	0	0	0	0	126
510	D	28.1	Very low	32.2	Very low	167 Å²	167	122.6 Å²	122.6	89%	0.893	73%	0.726	S	S	*	*			trans	76.9	160.1	160.9	-77.3	-22.7	0	0	0	124.8
511	V	37.6	Very low	32.7	Very low	131 Å²	131	125.8 Å²	125.8	79%	0.794	73%	0.729	S	S	*	*			trans	-137.5	142.3	-159.1	177.4	0	0	0	0	112.4
512	P	34.6	Very low	33.6	Very low	123 Å²	123	131.4 Å²	131.4	80%	0.799	75%	0.745	S	S	*	*			trans	-147.9	135.2	134.2	34.9	-17.6	0	0	0	117.5
513	A	29	Very low	34.2	Very low	82 Å²	82	133.7 Å²	133.7	68%	0.678	76%	0.759	S	S	*	*			trans	46.3	139.2	138.8	0	0	0	0	0	124.9
514	N	28.1	Very low	34.5	Very low	155 Å²	155	137.2 Å²	137.2	83%	0.829	77%	0.769	S	S	*	*			trans	75.9	123	153.7	-61.5	-15	0	0	0	120.6
515	P	35.2	Very low	34.8	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75.4	163	159.1	34.1	-34	0	0	0	111.6
516	P	32.4	Very low	35.2	Very low	119 Å²	119	134 Å²	134	77%	0.773	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-72.5	154.4	-174.2	29.5	-36.3	0	0	0	113.9
517	P	33.8	Very low	35.7	Very low	125 Å²	125	134 Å²	134	81%	0.812	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-73.6	146.6	179.7	30.7	-35.5	0	0	0	113.1
518	L	33.9	Very low	36.2	Very low	154 Å²	154	131.9 Å²	131.9	81%	0.806	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-72.2	152.8	172.3	-73.5	164.7	0	0	0	111.6	E520	L518-E520 PolarHBondContact O-N 3.11Å
519	P	33.1	Very low	36.8	Very low	118 Å²	118	128 Å²	128	77%	0.766	69%	0.694	S	S	*	*			trans	-74.3	99	-173.9	29.2	-35.3	0	0	0	113	K521	P519-K521 PolarHBondContact O-N 3.48Å
520	E	41.5	Very low	37.6	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-58.8	-14.1	-173.7	-57.4	-179.7	128.2	0	0	116.1	L518 K522 N523	L518-E520 PolarHBondContact O-N 3.11Å; E520-K522 PolarHBondContact O-N 2.67Å; E520-N523 PolarHBondContact O-N 2.8Å
521	K	42.1	Very low	38.1	Very low	207 Å²	207	125.8 Å²	125.8	90%	0.9	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-69.2	3.6	-165.1	-73.9	-168.8	175.3	-177.2	0	116.9	P519	P519-K521 PolarHBondContact O-N 3.48Å
522	K	45.4	Very low	38.1	Very low	181 Å²	181	122.9 Å²	122.9	79%	0.787	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-117.4	-16.1	170.9	-70.7	-170.2	176.1	-176	0	115	E520 R524	E520-K522 PolarHBondContact O-N 2.67Å; K522-R524 VanDerWaalsContact C-N 3.28Å; K522-R524 PolarHBondContact O-N 3.21Å
523	N	39.7	Very low	38.3	Very low	97 Å²	97	120.3 Å²	120.3	52%	0.519	62%	0.619	S	S	.	*	H	α-helix	trans	-73.1	-17.6	-179.6	-86.8	-1.8	0	0	0	113.8	E520 H525 I526 L527	E520-N523 PolarHBondContact O-N 2.8Å; N523-H525 PolarHBondContact O-N 3.46Å; N523-I526 PolarHBondContact O-N 2.91Å; N523-L527 HydrophobicContact CB-CD1 4.2Å; N523-L527 WeakPolarHBondContact O-CB 3.23Å; N523-L527 WeakPolarHBondContact O-CG 3.26Å; N523-L527 PolarHBondContact O-N 2.86Å
524	R	40.7	Very low	38.6	Very low	196 Å²	196	123 Å²	123	74%	0.74	62%	0.618	S	S	*	*	H	α-helix	trans	-61.4	-41.4	-173.4	-152.4	179.3	-157.2	-179.3	6.8	113	K522 Q528	K522-R524 VanDerWaalsContact C-N 3.28Å; K522-R524 PolarHBondContact O-N 3.21Å; R524-Q528 WeakPolarHBondContact O-CB 3.39Å; R524-Q528 PolarHBondContact O-N 2.87Å
525	H	44.9	Very low	38.6	Very low	101 Å²	101	121.8 Å²	121.8	47%	0.468	61%	0.611	S	S	.	*	H	α-helix	trans	-75.4	-33.4	178.3	-59.8	-37.3	0	0	0	112.7	N523 Q528 Y529	N523-H525 PolarHBondContact O-N 3.46Å; H525-Q528 PolarHBondContact O-N 3.01Å; H525-Y529 VanDerWaalsContact O-CB 3.27Å; H525-Y529 WeakPolarHBondContact O-CB 3.25Å; H525-Y529 PolarHBondContact O-N 3.11Å
526	I	43	Very low	38.3	Very low	90 Å²	90	122.3 Å²	122.3	46%	0.462	60%	0.599	S	S	.	*	H	α-helix	trans	-66.9	-47.8	175.2	-61.6	173.1	0	0	0	110.1	N523 Q528 Y529 M530	N523-I526 PolarHBondContact O-N 2.91Å; I526-Q528 PolarHBondContact O-N 3.3Å; I526-Y529 PolarHBondContact O-N 3.37Å; I526-M530 WeakPolarHBondContact O-CG 3.39Å; I526-M530 PolarHBondContact O-N 3.36Å
527	L	42.2	Very low	38.5	Very low	102 Å²	102	122.1 Å²	122.1	53%	0.534	60%	0.601	S	S	.	*	H	α-helix	trans	-65.6	-36.9	176	-70	171.5	0	0	0	112.1	N523 M530 Q531	N523-L527 HydrophobicContact CB-CD1 4.2Å; N523-L527 WeakPolarHBondContact O-CB 3.23Å; N523-L527 WeakPolarHBondContact O-CG 3.26Å; N523-L527 PolarHBondContact O-N 2.86Å; L527-M530 PolarHBondContact O-N 2.88Å; L527-Q531 VanDerWaalsContact O-CB 3.24Å; L527-Q531 WeakPolarHBondContact O-CB 3.47Å; L527-Q531 PolarHBondContact O-N 3.48Å
528	Q	37.8	Very low	39.1	Very low	112 Å²	112	123 Å²	123	52%	0.523	59%	0.593	S	S	.	*	H	α-helix	trans	-74.4	-26.6	177.5	-167.5	166.2	2.2	0	0	112.5	R524 H525 I526 F532	R524-Q528 WeakPolarHBondContact O-CB 3.39Å; R524-Q528 PolarHBondContact O-N 2.87Å; H525-Q528 PolarHBondContact O-N 3.01Å; I526-Q528 PolarHBondContact O-N 3.3Å; Q528-F532 WeakPolarHBondContact O-CB 3.43Å; Q528-F532 PolarHBondContact O-N 3.43Å
529	Y	41.9	Very low	39.3	Very low	56 Å²	56	117.7 Å²	117.7	22%	0.22	57%	0.569	C	S	.	*	H	α-helix	trans	-74.6	-41.7	167.5	178.2	-95.7	0	0	0	112	H525 I526 F532 M533 F1100	H525-Y529 VanDerWaalsContact O-CB 3.27Å; H525-Y529 WeakPolarHBondContact O-CB 3.25Å; H525-Y529 PolarHBondContact O-N 3.11Å; I526-Y529 PolarHBondContact O-N 3.37Å; Y529-F532 PolarHBondContact O-N 3.15Å; Y529-M533 HydrophobicContact CD1-CG 4.16Å; Y529-M533 HydrophobicContact CE1-CG 3.76Å; Y529-M533 HydrophobicContact CE1-SD 3.84Å; Y529-M533 HydrophobicContact CE2-CG 4.29Å; Y529-M533 WeakPolarHBondContact O-CB 3.27Å; Y529-M533 VanDerWaalsContact O-CG 3.28Å; Y529-M533 WeakPolarHBondContact O-CG 3.35Å; Y529-M533 PolarHBondContact O-N 3.38Å; Y529-M533 PolarHBondContact OH-SD 3.11Å; Y529-F1100 HydrophobicContact CD1-CD2 4.42Å; Y529-F1100 HydrophobicContact CD1-CE2 4.23Å; Y529-F1100 AromaticContact CE1-CD2 3.75Å; Y529-F1100 HydrophobicContact CE1-CD2 3.75Å; Y529-F1100 AromaticContact CE1-CE2 3.99Å; Y529-F1100 HydrophobicContact CE1-CE2 3.99Å
530	M	44.1	Very low	39.7	Very low	91 Å²	91	113.7 Å²	113.7	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-58.8	-49	171.9	-77.2	-177.1	64	0	0	110.8	I526 L527 F532 M533 E534	I526-M530 WeakPolarHBondContact O-CG 3.39Å; I526-M530 PolarHBondContact O-N 3.36Å; L527-M530 PolarHBondContact O-N 2.88Å; M530-F532 VanDerWaalsContact C-N 3.32Å; M530-F532 PolarHBondContact O-N 3.06Å; M530-M533 CarbonylContact O-C 3.57Å; M530-M533 WeakPolarHBondContact O-CA 3.46Å; M530-M533 WeakPolarHBondContact O-CB 3.41Å; M530-M533 PolarHBondContact O-N 2.65Å; M530-E534 WeakPolarHBondContact O-CG 3.32Å; M530-E534 PolarHBondContact O-N 3.44Å
531	Q	39.8	Very low	39.7	Very low	117 Å²	117	106.6 Å²	106.6	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-38.3	178	-169.4	167.1	13.6	0	0	111.9	L527 M533 E534 D535	L527-Q531 VanDerWaalsContact O-CB 3.24Å; L527-Q531 WeakPolarHBondContact O-CB 3.47Å; L527-Q531 PolarHBondContact O-N 3.48Å; Q531-M533 VanDerWaalsContact C-N 3.32Å; Q531-M533 PolarHBondContact O-N 3.41Å; Q531-E534 PolarHBondContact O-N 3.31Å; Q531-D535 WeakPolarHBondContact O-CB 3.31Å; Q531-D535 PolarHBondContact O-N 2.91Å
532	F	36.1	Very low	39.7	Very low	70 Å²	70	96.9 Å²	96.9	31%	0.307	47%	0.466	S	S	.	.	H	α-helix	trans	-65.1	-31	171.6	172.7	-96.2	0	0	0	113.4	Q528 Y529 M530 Y536 H557 F561	Q528-F532 WeakPolarHBondContact O-CB 3.43Å; Q528-F532 PolarHBondContact O-N 3.43Å; Y529-F532 PolarHBondContact O-N 3.15Å; M530-F532 VanDerWaalsContact C-N 3.32Å; M530-F532 PolarHBondContact O-N 3.06Å; F532-Y536 HydrophobicContact CE1-CE2 4.19Å; F532-Y536 AromaticContact CZ-CE2 3.98Å; F532-Y536 HydrophobicContact CZ-CE2 3.98Å; F532-H557 AromaticContact CZ-NE2 3.28Å; F532-H557 VanDerWaalsContact CZ-NE2 3.28Å; F532-H557 WeakPolarHBondContact CZ-NE2 3.34Å; F532-F561 HydrophobicContact CE1-CE2 4.45Å; F532-F561 HydrophobicContact CE1-CZ 4.22Å; F532-F561 HydrophobicContact CZ-CE2 4.26Å; F532-F561 HydrophobicContact CZ-CZ 4.48Å
533	M	40	Very low	39.8	Very low	69 Å²	69	91.3 Å²	91.3	34%	0.34	45%	0.447	S	S	.	.	H	α-helix	trans	-79.7	-28.5	172.5	-70.4	-121.5	67.5	0	0	113	Y529 M530 Q531 Y536	Y529-M533 HydrophobicContact CD1-CG 4.16Å; Y529-M533 HydrophobicContact CE1-CG 3.76Å; Y529-M533 HydrophobicContact CE1-SD 3.84Å; Y529-M533 HydrophobicContact CE2-CG 4.29Å; Y529-M533 WeakPolarHBondContact O-CB 3.27Å; Y529-M533 VanDerWaalsContact O-CG 3.28Å; Y529-M533 WeakPolarHBondContact O-CG 3.35Å; Y529-M533 PolarHBondContact O-N 3.38Å; Y529-M533 PolarHBondContact OH-SD 3.11Å; M530-M533 CarbonylContact O-C 3.57Å; M530-M533 WeakPolarHBondContact O-CA 3.46Å; M530-M533 WeakPolarHBondContact O-CB 3.41Å; M530-M533 PolarHBondContact O-N 2.65Å; Q531-M533 VanDerWaalsContact C-N 3.32Å; Q531-M533 PolarHBondContact O-N 3.41Å; M533-Y536 WeakPolarHBondContact O-CB 3.42Å; M533-Y536 PolarHBondContact O-N 2.97Å
534	E	35.6	Very low	40.1	Very low	140 Å²	140	89.6 Å²	89.6	65%	0.654	44%	0.435	S	S	*	.	H	α-helix	trans	-75	-30.1	173.4	-72.1	169.8	164.1	0	0	111.9	M530 Q531 Y536	M530-E534 WeakPolarHBondContact O-CG 3.32Å; M530-E534 PolarHBondContact O-N 3.44Å; Q531-E534 PolarHBondContact O-N 3.31Å; E534-Y536 PolarHBondContact O-N 3.49Å
535	D	28.3	Very low	40.2	Very low	129 Å²	129	80.9 Å²	80.9	69%	0.69	40%	0.402	S	S	*	.	S	Bend	trans	-68.4	-14.7	171.7	-79.4	-29.7	0	0	0	112.8	Q531 S537	Q531-D535 WeakPolarHBondContact O-CB 3.31Å; Q531-D535 PolarHBondContact O-N 2.91Å; D535-S537 PolarHBondContact O-N 3.04Å
536	Y	28.4	Very low	40.1	Very low	127 Å²	127	78.8 Å²	78.8	50%	0.498	39%	0.393	S	S	.	.	S	Bend	trans	-75.9	106.5	162	-88.7	-98	0	0	0	110	F532 M533 E534 E538	F532-Y536 HydrophobicContact CE1-CE2 4.19Å; F532-Y536 AromaticContact CZ-CE2 3.98Å; F532-Y536 HydrophobicContact CZ-CE2 3.98Å; M533-Y536 WeakPolarHBondContact O-CB 3.42Å; M533-Y536 PolarHBondContact O-N 2.97Å; E534-Y536 PolarHBondContact O-N 3.49Å; Y536-E538 PolarHBondContact O-N 2.96Å
537	S	37	Very low	39.8	Very low	116 Å²	116	78.3 Å²	78.3	81%	0.811	39%	0.39	S	S	*	.			trans	-54.8	128.1	161.9	-62.7	0	0	0	0	109.6	D535	D535-S537 PolarHBondContact O-N 3.04Å
538	E	45.2	Very low	39.3	Very low	142 Å²	142	76.8 Å²	76.8	66%	0.664	39%	0.386	S	S	*	.			trans	-38.7	114.2	-160.5	-69.9	-177.7	106.6	0	0	114.9	Y536 Q540 S1069	Y536-E538 PolarHBondContact O-N 2.96Å; E538-Q540 PolarHBondContact O-N 3.09Å; E538-S1069 VanDerWaalsContact OE1-CB 3.27Å; E538-S1069 WeakPolarHBondContact OE1-CB 3.39Å; E538-S1069 PolarHBondContact OE1-OG 2.72Å
539	P	37.6	Very low	39.2	Very low	44 Å²	44	80 Å²	80	29%	0.286	40%	0.401	S	S	.	.			trans	-62.5	122	170.7	23.4	-30.5	0	0	0	109.7	V543 F544	P539-V543 HydrophobicContact CB-CB 3.72Å; P539-V543 HydrophobicContact CB-CG1 3.73Å; P539-F544 HydrophobicContact CB-CD2 4.36Å; P539-F544 HydrophobicContact CB-CE2 4.04Å; P539-F544 HydrophobicContact CG-CE2 3.82Å; P539-F544 HydrophobicContact CG-CZ 3.87Å; P539-F544 WeakPolarHBondContact O-CE2 3.24Å
540	Q	42.8	Very low	38.9	Very low	34 Å²	34	79.8 Å²	79.8	16%	0.159	41%	0.408	C	S	.	.			trans	-53.6	153.1	166.2	-70.2	-83.7	-67.2	0	0	109.8	E538 S542 V543 D1043	E538-Q540 PolarHBondContact O-N 3.09Å; Q540-S542 PolarHBondContact O-N 3.13Å; Q540-V543 HydrophobicContact CB-CG2 4.19Å; Q540-V543 WeakPolarHBondContact O-CB 3.46Å; Q540-V543 PolarHBondContact O-N 3.09Å; Q540-D1043 PolarHBondContact NE2-OD2 3.06Å; Q540-D1043 PolarHBondContact OE1-O 2.94Å
541	P	40.9	Very low	38.3	Very low	17 Å²	17	82.7 Å²	82.7	11%	0.11	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-23.8	178.9	-27.3	32.7	0	0	0	115.3	F992 L1036 Y1090	P541-F992 HydrophobicContact CB-CZ 4.28Å; P541-L1036 HydrophobicContact CB-CB 4.25Å; P541-Y1090 WeakPolarHBondContact CA-OH 3.49Å; P541-Y1090 HydrophobicContact CB-CE2 4.35Å; P541-Y1090 PolarHBondContact O-OH 3.2Å
542	S	41.3	Very low	38.1	Very low	4 Å²	4	86.4 Å²	86.4	3%	0.028	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-28.9	171.6	66.1	0	0	0	0	114.1	Q540 F544 Y545 Q546 R1000	Q540-S542 PolarHBondContact O-N 3.13Å; S542-F544 VanDerWaalsContact C-N 3.34Å; S542-F544 PolarHBondContact O-N 3.45Å; S542-Y545 CarbonylContact O-C 3.55Å; S542-Y545 PolarHBondContact O-N 3.07Å; S542-Y545 VanDerWaalsContact O-N 3.15Å; S542-Q546 WeakPolarHBondContact O-CB 3.18Å; S542-Q546 PolarHBondContact O-N 3.28Å; S542-Q546 VanDerWaalsContact O-N 3.08Å; S542-R1000 PolarHBondContact OG-NH2 3.11Å
543	V	48	Very low	38.2	Very low	63 Å²	63	88.4 Å²	88.4	38%	0.382	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-70.6	-30.5	-176.8	179.1	0	0	0	0	111.6	P539 Q540 Y545 Q546	P539-V543 HydrophobicContact CB-CB 3.72Å; P539-V543 HydrophobicContact CB-CG1 3.73Å; Q540-V543 HydrophobicContact CB-CG2 4.19Å; Q540-V543 WeakPolarHBondContact O-CB 3.46Å; Q540-V543 PolarHBondContact O-N 3.09Å; V543-Y545 PolarHBondContact O-N 3.33Å; V543-Y545 VanDerWaalsContact O-N 3.16Å; V543-Q546 PolarHBondContact O-N 2.69Å; V543-Q546 VanDerWaalsContact O-N 3.08Å
544	F	46.5	Very low	38.4	Very low	61 Å²	61	90.2 Å²	90.2	27%	0.268	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-61.3	-20.2	171.8	-68.4	-96.4	0	0	0	113.7	P539 S542 F1073 Y1090	P539-F544 HydrophobicContact CB-CD2 4.36Å; P539-F544 HydrophobicContact CB-CE2 4.04Å; P539-F544 HydrophobicContact CG-CE2 3.82Å; P539-F544 HydrophobicContact CG-CZ 3.87Å; P539-F544 WeakPolarHBondContact O-CE2 3.24Å; S542-F544 VanDerWaalsContact C-N 3.34Å; S542-F544 PolarHBondContact O-N 3.45Å; F544-F1073 HydrophobicContact CZ-CZ 4.25Å; F544-Y1090 WeakPolarHBondContact CB-OH 3.01Å; F544-Y1090 VanDerWaalsContact CD2-OH 3.27Å; F544-Y1090 WeakPolarHBondContact CD2-OH 3.49Å; F544-Y1090 WeakPolarHBondContact CG-OH 3.37Å
545	Y	43.8	Very low	38.7	Very low	13 Å²	13	89.1 Å²	89.1	5%	0.051	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-113.7	5.4	175.9	-63	-44	0	0	0	112.8	S542 V543 M547 T989 F992 N993 Y1090 L1091 G1092 L1095	S542-Y545 CarbonylContact O-C 3.55Å; S542-Y545 PolarHBondContact O-N 3.07Å; S542-Y545 VanDerWaalsContact O-N 3.15Å; V543-Y545 PolarHBondContact O-N 3.33Å; V543-Y545 VanDerWaalsContact O-N 3.16Å; Y545-M547 PolarHBondContact O-N 2.99Å; Y545-T989 HydrophobicContact CD1-CG2 3.31Å; Y545-T989 HydrophobicContact CE1-CG2 3.41Å; Y545-T989 VanDerWaalsContact CE1-CG2 3.41Å; Y545-T989 HydrophobicContact CG-CG2 3.99Å; Y545-F992 HydrophobicContact CD2-CB 4.14Å; Y545-F992 AromaticContact CD2-CD1 3.48Å; Y545-F992 HydrophobicContact CD2-CD1 3.48Å; Y545-F992 VanDerWaalsContact CD2-CD1 3.48Å; Y545-F992 HydrophobicContact CD2-CD2 4.08Å; Y545-F992 AromaticContact CD2-CE1 3.8Å; Y545-F992 HydrophobicContact CD2-CE1 3.8Å; Y545-F992 HydrophobicContact CD2-CE2 4.33Å; Y545-F992 AromaticContact CD2-CG 3.64Å; Y545-F992 HydrophobicContact CD2-CG 3.64Å; Y545-F992 HydrophobicContact CD2-CZ 4.19Å; Y545-F992 HydrophobicContact CE2-CB 4.22Å; Y545-F992 AromaticContact CE2-CD1 3.98Å; Y545-F992 HydrophobicContact CE2-CD1 3.98Å; Y545-F992 AromaticContact CE2-CD2 3.69Å; Y545-F992 HydrophobicContact CE2-CD2 3.69Å; Y545-F992 HydrophobicContact CE2-CE1 4.23Å; Y545-F992 AromaticContact CE2-CE2 3.92Å; Y545-F992 HydrophobicContact CE2-CE2 3.92Å; Y545-F992 AromaticContact CE2-CG 3.71Å; Y545-F992 HydrophobicContact CE2-CG 3.71Å; Y545-F992 HydrophobicContact CE2-CZ 4.19Å; Y545-N993 PolarHBondContact O-ND2 3.06Å; Y545-Y1090 HydrophobicContact CD2-CE2 4.15Å; Y545-Y1090 AromaticContact CE2-CD2 3.87Å; Y545-Y1090 HydrophobicContact CE2-CD2 3.87Å; Y545-Y1090 AromaticContact CE2-CE2 3.41Å; Y545-Y1090 HydrophobicContact CE2-CE2 3.41Å; Y545-Y1090 VanDerWaalsContact CE2-CE2 3.41Å; Y545-Y1090 AromaticContact CZ-CE2 3.89Å; Y545-L1091 WeakPolarHBondContact OH-CA 3.48Å; Y545-L1091 WeakPolarHBondContact OH-CB 3.4Å; Y545-L1091 PolarHBondContact OH-N 3.34Å; Y545-G1092 PolarHBondContact OH-N 3.1Å; Y545-L1095 HydrophobicContact CE1-CD1 4.38Å
546	Q	41.1	Very low	39.2	Very low	57 Å²	57	90 Å²	90	27%	0.266	44%	0.44	S	S	.	.			trans	-92.5	95.5	-178.7	-167.9	161.2	6.8	0	0	109.1	S542 V543 Y997 E1157	S542-Q546 WeakPolarHBondContact O-CB 3.18Å; S542-Q546 PolarHBondContact O-N 3.28Å; S542-Q546 VanDerWaalsContact O-N 3.08Å; V543-Q546 PolarHBondContact O-N 2.69Å; V543-Q546 VanDerWaalsContact O-N 3.08Å; Q546-Y997 PolarHBondContact NE2-OH 3.25Å; Q546-E1157 PolarHBondContact NE2-OE2 3.37Å
547	M	36.7	Very low	39.7	Very low	80 Å²	80	87 Å²	87	39%	0.394	43%	0.431	S	S	.	.			trans	-52.3	128.6	170.6	-80.2	-78.6	92.3	0	0	109.9	Y545 Q549 W973	Y545-M547 PolarHBondContact O-N 2.99Å; M547-Q549 PolarHBondContact O-N 3.09Å; M547-W973 HydrophobicContact CE-CH2 4.31Å; M547-W973 HydrophobicContact CE-CZ2 3.96Å; M547-W973 HydrophobicContact SD-CH2 4.32Å
548	P	32.3	Very low	40	Very low	70 Å²	70	85.6 Å²	85.6	46%	0.455	41%	0.414	S	S	.	.			trans	-62.9	111.4	179.3	-22.3	33.1	0	0	0	110.4	S550 Y554	P548-S550 PolarHBondContact O-N 3.3Å; P548-Y554 HydrophobicContact CG-CD2 4.46Å
549	Q	34.8	Very low	39.7	Very low	180 Å²	180	85.5 Å²	85.5	84%	0.841	41%	0.411	S	S	*	.	S	Bend	trans	-64	8.1	179.4	-63.5	-173.5	0.7	0	0	114.6	M547	M547-Q549 PolarHBondContact O-N 3.09Å
550	S	35.6	Very low	39.9	Very low	52 Å²	52	88.3 Å²	88.3	36%	0.364	42%	0.424	S	S	.	.			trans	-127.6	83	174.6	50.4	0	0	0	0	109.5	P548 R552 I553	P548-S550 PolarHBondContact O-N 3.3Å; S550-R552 PolarHBondContact O-N 2.8Å; S550-I553 PolarHBondContact O-N 2.71Å; S550-I553 WeakPolarHBondContact OG-CD1 3.31Å; S550-I553 WeakPolarHBondContact OG-CG1 3.45Å
551	E	33	Very low	39.8	Very low	151 Å²	151	90 Å²	90	71%	0.706	43%	0.43	S	S	*	.	H	α-helix	trans	-32.6	-48.1	167.7	-170.7	173.5	-134	0	0	112.3	I553 Y554 E555	E551-I553 PolarHBondContact O-N 2.8Å; E551-Y554 CarbonylContact O-C 3.58Å; E551-Y554 WeakPolarHBondContact O-CA 3.49Å; E551-Y554 WeakPolarHBondContact O-CB 3.47Å; E551-Y554 PolarHBondContact O-N 2.81Å; E551-E555 WeakPolarHBondContact O-CG 3.3Å; E551-E555 PolarHBondContact O-N 2.92Å
552	R	35.1	Very low	40	Very low	196 Å²	196	95.1 Å²	95.1	74%	0.74	45%	0.453	S	S	*	.	H	α-helix	trans	-57	-35.2	177.2	-67.2	-177.6	179.7	167.7	1.8	116	S550 Y554 Q556	S550-R552 PolarHBondContact O-N 2.8Å; R552-Y554 VanDerWaalsContact C-N 3.34Å; R552-Q556 WeakPolarHBondContact O-CB 3.25Å; R552-Q556 PolarHBondContact O-N 3.4Å
553	I	38	Very low	40.1	Very low	112 Å²	112	101.7 Å²	101.7	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-69	-40.8	176.1	-63.6	-171	0	0	0	108.8	S550 E551 Q556 H557	S550-I553 PolarHBondContact O-N 2.71Å; S550-I553 WeakPolarHBondContact OG-CD1 3.31Å; S550-I553 WeakPolarHBondContact OG-CG1 3.45Å; E551-I553 PolarHBondContact O-N 2.8Å; I553-Q556 PolarHBondContact O-N 3.14Å; I553-H557 WeakPolarHBondContact O-CB 3.25Å; I553-H557 PolarHBondContact O-N 3.05Å
554	Y	43.6	Very low	39.7	Very low	106 Å²	106	103.2 Å²	103.2	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-70.3	-40.8	178.5	-158.3	-98.9	0	0	0	112.4	P548 E551 R552 H557 N558 Q977	P548-Y554 HydrophobicContact CG-CD2 4.46Å; E551-Y554 CarbonylContact O-C 3.58Å; E551-Y554 WeakPolarHBondContact O-CA 3.49Å; E551-Y554 WeakPolarHBondContact O-CB 3.47Å; E551-Y554 PolarHBondContact O-N 2.81Å; R552-Y554 VanDerWaalsContact C-N 3.34Å; Y554-H557 PolarHBondContact O-N 3.24Å; Y554-N558 WeakPolarHBondContact O-CB 3.37Å; Y554-N558 PolarHBondContact O-N 2.72Å; Y554-Q977 PolarHBondContact OH-OE1 3.08Å
555	E	43	Very low	39.4	Very low	117 Å²	117	105.7 Å²	105.7	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-59.4	-47.4	171.6	-69.7	-177.2	122.2	0	0	112.2	E551 H557 N558 K559	E551-E555 WeakPolarHBondContact O-CG 3.3Å; E551-E555 PolarHBondContact O-N 2.92Å; E555-H557 VanDerWaalsContact C-N 3.32Å; E555-H557 PolarHBondContact O-N 3.04Å; E555-N558 PolarHBondContact O-N 3.35Å; E555-K559 PolarHBondContact O-N 3.17Å
556	Q	38.6	Very low	39	Very low	147 Å²	147	108 Å²	108	69%	0.687	53%	0.529	S	S	*	.	H	α-helix	trans	-66.8	-36.4	179.4	-174.9	172.6	-9.2	0	0	111.5	R552 I553 L560	R552-Q556 WeakPolarHBondContact O-CB 3.25Å; R552-Q556 PolarHBondContact O-N 3.4Å; I553-Q556 PolarHBondContact O-N 3.14Å; Q556-L560 PolarHBondContact O-N 2.89Å
557	H	38.6	Very low	38.6	Very low	66 Å²	66	113.3 Å²	113.3	31%	0.306	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-47.3	174	-173.5	-98.3	0	0	0	111.8	F532 I553 Y554 E555 K559 L560 F561	F532-H557 AromaticContact CZ-NE2 3.28Å; F532-H557 VanDerWaalsContact CZ-NE2 3.28Å; F532-H557 WeakPolarHBondContact CZ-NE2 3.34Å; I553-H557 WeakPolarHBondContact O-CB 3.25Å; I553-H557 PolarHBondContact O-N 3.05Å; Y554-H557 PolarHBondContact O-N 3.24Å; E555-H557 VanDerWaalsContact C-N 3.32Å; E555-H557 PolarHBondContact O-N 3.04Å; H557-K559 PolarHBondContact O-N 3.5Å; H557-L560 PolarHBondContact O-N 3.45Å; H557-F561 AromaticContact CE1-CD2 3.71Å; H557-F561 AromaticContact CE1-CE2 3.31Å; H557-F561 WeakPolarHBondContact CE1-CE2 3.24Å; H557-F561 AromaticContact ND1-CD2 3.93Å; H557-F561 AromaticContact NE2-CE2 3.47Å; H557-F561 WeakPolarHBondContact NE2-CE2 3.42Å; H557-F561 WeakPolarHBondContact O-CD2 3.44Å; H557-F561 PolarHBondContact O-N 2.94Å
558	N	44.1	Very low	38.3	Very low	85 Å²	85	117.2 Å²	117.2	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-64.3	-38.7	179.2	-159.3	6.9	0	0	0	111.8	Y554 E555 F561 Q562	Y554-N558 WeakPolarHBondContact O-CB 3.37Å; Y554-N558 PolarHBondContact O-N 2.72Å; E555-N558 PolarHBondContact O-N 3.35Å; N558-F561 PolarHBondContact O-N 3.12Å; N558-Q562 PolarHBondContact O-N 2.88Å
559	K	38.9	Very low	38.1	Very low	140 Å²	140	120.9 Å²	120.9	61%	0.609	59%	0.589	S	S	*	*	H	α-helix	trans	-60.1	-48.5	170	-84.4	-169.4	171.2	-175	0	113	E555 H557 F561 Q562 E563	E555-K559 PolarHBondContact O-N 3.17Å; H557-K559 PolarHBondContact O-N 3.5Å; K559-F561 VanDerWaalsContact C-N 3.25Å; K559-F561 PolarHBondContact O-N 3.49Å; K559-Q562 PolarHBondContact O-N 3.13Å; K559-Q562 VanDerWaalsContact O-N 3.11Å; K559-E563 PolarHBondContact O-N 2.79Å
560	L	41.2	Very low	37.8	Very low	104 Å²	104	117.1 Å²	117.1	55%	0.545	58%	0.583	S	S	.	*	H	α-helix	trans	-64.5	-33.4	-179.1	-152.1	76.3	0	0	0	111.6	Q556 H557 E563 V564	Q556-L560 PolarHBondContact O-N 2.89Å; H557-L560 PolarHBondContact O-N 3.45Å; L560-E563 PolarHBondContact O-N 3.44Å; L560-V564 VanDerWaalsContact O-CG2 3.29Å; L560-V564 WeakPolarHBondContact O-CG2 3.08Å; L560-V564 PolarHBondContact O-N 3.49Å
561	F	41.2	Very low	37.3	Very low	68 Å²	68	125.3 Å²	125.3	30%	0.298	61%	0.613	S	S	.	*	H	α-helix	trans	-64.1	-41.7	171.3	-98.6	-103.8	0	0	0	112.7	F532 H557 N558 K559 V564 Y565	F532-F561 HydrophobicContact CE1-CE2 4.45Å; F532-F561 HydrophobicContact CE1-CZ 4.22Å; F532-F561 HydrophobicContact CZ-CE2 4.26Å; F532-F561 HydrophobicContact CZ-CZ 4.48Å; H557-F561 AromaticContact CE1-CD2 3.71Å; H557-F561 AromaticContact CE1-CE2 3.31Å; H557-F561 WeakPolarHBondContact CE1-CE2 3.24Å; H557-F561 AromaticContact ND1-CD2 3.93Å; H557-F561 AromaticContact NE2-CE2 3.47Å; H557-F561 WeakPolarHBondContact NE2-CE2 3.42Å; H557-F561 WeakPolarHBondContact O-CD2 3.44Å; H557-F561 PolarHBondContact O-N 2.94Å; N558-F561 PolarHBondContact O-N 3.12Å; K559-F561 VanDerWaalsContact C-N 3.25Å; K559-F561 PolarHBondContact O-N 3.49Å; F561-V564 PolarHBondContact O-N 3.24Å; F561-Y565 HydrophobicContact CD1-CE2 4.46Å; F561-Y565 WeakPolarHBondContact O-CD2 3.48Å; F561-Y565 PolarHBondContact O-N 2.85Å
562	Q	45.6	Very low	36.9	Very low	126 Å²	126	122.8 Å²	122.8	59%	0.589	61%	0.611	S	S	*	*	H	α-helix	trans	-65.5	-40	174.9	-72.6	177.9	-16.5	0	0	112.3	N558 K559 Y565 G566	N558-Q562 PolarHBondContact O-N 2.88Å; K559-Q562 PolarHBondContact O-N 3.13Å; K559-Q562 VanDerWaalsContact O-N 3.11Å; Q562-Y565 PolarHBondContact O-N 3.29Å; Q562-G566 PolarHBondContact O-N 3.27Å
563	E	42.2	Very low	36.3	Very low	142 Å²	142	119.5 Å²	119.5	66%	0.664	62%	0.618	S	S	*	*	H	α-helix	trans	-64.1	-38.1	176.3	-72	176.8	-177.6	0	0	112.8	K559 L560	K559-E563 PolarHBondContact O-N 2.79Å; L560-E563 PolarHBondContact O-N 3.44Å
564	V	40.9	Very low	35.7	Very low	95 Å²	95	119.8 Å²	119.8	58%	0.576	63%	0.626	S	S	*	*	H	α-helix	trans	-71.5	-31.3	-179.7	167.7	0	0	0	0	113.2	L560 F561	L560-V564 VanDerWaalsContact O-CG2 3.29Å; L560-V564 WeakPolarHBondContact O-CG2 3.08Å; L560-V564 PolarHBondContact O-N 3.49Å; F561-V564 PolarHBondContact O-N 3.24Å
565	Y	38.7	Very low	34.8	Very low	113 Å²	113	121.5 Å²	121.5	44%	0.443	64%	0.642	S	S	.	*	H	α-helix	trans	-97.2	2.3	-176.9	-79.2	-79.9	0	0	0	115.3	F561 Q562 F567	F561-Y565 HydrophobicContact CD1-CE2 4.46Å; F561-Y565 WeakPolarHBondContact O-CD2 3.48Å; F561-Y565 PolarHBondContact O-N 2.85Å; Q562-Y565 PolarHBondContact O-N 3.29Å; Y565-F567 PolarHBondContact O-N 3.02Å
566	G	36.8	Very low	34	Very low	61 Å²	61	120.3 Å²	120.3	63%	0.629	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	23.1	161.5	0	0	0	0	0	116.5	Q562 N568	Q562-G566 PolarHBondContact O-N 3.27Å; G566-N568 PolarHBondContact O-N 3.03Å
567	F	32.4	Very low	33.3	Very low	169 Å²	169	118.7 Å²	118.7	74%	0.741	65%	0.647	S	S	*	*			trans	-74	87.2	173	-88.7	-88	0	0	0	111.5	Y565 D569	Y565-F567 PolarHBondContact O-N 3.02Å; F567-D569 PolarHBondContact O-N 2.89Å
568	N	30.8	Very low	32.7	Very low	162 Å²	162	124.8 Å²	124.8	87%	0.866	68%	0.675	S	S	*	*			trans	-88.2	79.8	165.4	-91.5	-21.9	0	0	0	110.4	G566	G566-N568 PolarHBondContact O-N 3.03Å
569	D	27	Very low	31.9	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	69%	0.689	S	S	*	*			trans	-104.7	126.5	156.3	-102.7	-49.7	0	0	0	109.1	F567	F567-D569 PolarHBondContact O-N 2.89Å
570	S	28.7	Very low	31.3	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	70%	0.697	S	S	*	*			trans	-154.4	88.1	-178.5	-83	0	0	0	0	112.2
571	F	25.1	Very low	30.6	Very low	224 Å²	224	130.9 Å²	130.9	98%	0.982	72%	0.715	S	S	*	*			trans	-121.5	137	139.8	-88	-76	0	0	0	109.9
572	S	25	Very low	30	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	74%	0.742	S	S	*	*			trans	-102.1	148.3	-155.6	-174.1	0	0	0	0	112.9
573	S	22.5	Very low	29.2	Very low	127 Å²	127	136 Å²	136	89%	0.888	75%	0.75	S	S	*	*			trans	-121	118	157.8	-70.3	0	0	0	0	109
574	T	25	Very low	28.5	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	76%	0.759	S	S	*	*			trans	-125.6	142.6	176.1	44.4	0	0	0	0	108.6
575	D	23.8	Very low	28	Very low	142 Å²	142	135.9 Å²	135.9	76%	0.759	77%	0.771	S	S	*	*			cis	-149.7	176.7	1.3	-150.8	-35.2	0	0	0	109.8
576	S	27	Very low	27.6	Very low	91 Å²	91	138.7 Å²	138.7	64%	0.636	79%	0.793	S	S	*	*			trans	-50.8	173.2	161.2	61	0	0	0	0	113.7
577	V	23.4	Very low	27.3	Very low	114 Å²	114	141.2 Å²	141.2	69%	0.691	80%	0.799	S	S	*	*			cis	-150.7	150.6	27.3	-172	0	0	0	0	110
578	H	26.5	Very low	27.5	Very low	194 Å²	194	138.2 Å²	138.2	90%	0.898	80%	0.796	S	S	*	*			trans	-148.1	135.9	138.3	-129	-69.9	0	0	0	112.8
579	E	26.4	Very low	27.3	Very low	160 Å²	160	139.4 Å²	139.4	75%	0.748	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91	142.8	-170	-171.4	179.9	167.8	0	0	112.3
580	P	26.9	Very low	27.4	Very low	120 Å²	120	141.4 Å²	141.4	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.7	141.4	-179.2	30.4	-35	0	0	0	113.4
581	L	25.8	Very low	27.4	Very low	177 Å²	177	147 Å²	147	93%	0.927	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.5	135.8	-179.9	-70.1	164.3	0	0	0	112.4
582	Q	29.2	Very low	27.6	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-86.6	159.2	169.6	-91.7	-167.8	-4.2	0	0	113
583	P	28.5	Very low	27.7	Very low	115 Å²	115	146.8 Å²	146.8	75%	0.747	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.6	161.5	-167	28.6	-36.5	0	0	0	115.1
584	P	28.5	Very low	27.9	Very low	133 Å²	133	144.5 Å²	144.5	86%	0.864	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-78.8	147.5	-171.5	31.6	-36.5	0	0	0	114.5
585	A	29.2	Very low	27.9	Very low	100 Å²	100	143.2 Å²	143.2	83%	0.826	78%	0.784	S	S	*	*			trans	-120.4	154.7	169.2	0	0	0	0	0	111.8
586	L	31.3	Very low	28.1	Very low	172 Å²	172	144.9 Å²	144.9	90%	0.901	79%	0.787	S	S	*	*			trans	-84.3	166.7	-166.2	-81.9	169.8	0	0	0	114.6
587	P	30.3	Very low	28	Very low	115 Å²	115	145.6 Å²	145.6	75%	0.747	79%	0.792	S	S	*	*			trans	-81.3	169.8	-155.8	31.3	-36.9	0	0	0	117
588	P	36.4	Very low	28.2	Very low	105 Å²	105	145.7 Å²	145.7	68%	0.682	80%	0.797	S	S	*	*			trans	-122.8	177.5	-150.6	41.8	-30.9	0	0	0	117.6
589	K	27.5	Very low	28.1	Very low	187 Å²	187	141.8 Å²	141.8	81%	0.813	79%	0.792	S	S	*	*			trans	104.6	119.6	155.9	-60.7	156	-179.4	170.9	0	117.4
590	Q	28.2	Very low	29.4	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	79%	0.791	S	S	*	*				-178.5	167.2	97	-88.7	172.7	24.5	0	0	108.3
591	R	29.1	Very low	29.3	Very low	218 Å²	218	138.5 Å²	138.5	82%	0.823	79%	0.787	S	S	*	*			cis	162.6	144.4	-35.4	-165.5	-170.8	-161.1	-167.3	7	104.9
592	Q	28.9	Very low	29.4	Very low	165 Å²	165	135 Å²	135	77%	0.771	78%	0.777	S	S	*	*			trans	76.6	150.5	175.2	-53	-175.9	-51.1	0	0	115.8
593	L	27.3	Very low	29.2	Very low	152 Å²	152	131.1 Å²	131.1	80%	0.796	77%	0.771	S	S	*	*			cis	-162.2	172.1	-17.5	-112.1	169.8	0	0	0	110.8
594	A	26.6	Very low	29.1	Very low	80 Å²	80	130.6 Å²	130.6	66%	0.661	77%	0.77	S	S	*	*			trans	69.6	83.4	152.9	0	0	0	0	0	122.3
595	S	25.8	Very low	29	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	76%	0.763	S	S	*	*				41	129.3	114.1	64.2	0	0	0	0	124.2
596	H	27.3	Very low	28.8	Very low	177 Å²	177	129.4 Å²	129.4	82%	0.819	76%	0.759	S	S	*	*			trans	124.6	137.6	132.5	-70.2	-61.5	0	0	0	119.8
597	S	25.3	Very low	28.5	Very low	107 Å²	107	126 Å²	126	75%	0.748	75%	0.749	S	S	*	*			trans	93.5	123.2	147.1	74	0	0	0	0	122.3
598	S	26.8	Very low	28.3	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	76%	0.755	S	S	*	*			trans	39.8	126.7	143.2	52.7	0	0	0	0	123.6
599	S	25.9	Very low	27.8	Very low	112 Å²	112	128 Å²	128	78%	0.783	75%	0.754	S	S	*	*			trans	-77.9	-179.8	151.8	50.9	0	0	0	0	112
600	P	53.1	Low	27.6	Very low	111 Å²	111	124.5 Å²	124.5	72%	0.721	75%	0.752	S	S	*	*			cis	-130.6	-172.9	-9.9	31.7	-10.5	0	0	0	114.1
601	S	25.3	Very low	27.4	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	75%	0.746	S	S	*	*			trans	127.1	131	135	-50.2	0	0	0	0	118.7
602	S	26.8	Very low	27.3	Very low	104 Å²	104	120.7 Å²	120.7	73%	0.727	75%	0.748	S	S	*	*			trans	58.6	122.7	134.3	66.9	0	0	0	0	123.7
603	S	25.9	Very low	27	Very low	105 Å²	105	121 Å²	121	73%	0.734	75%	0.75	S	S	*	*				86	115.6	127	-62.5	0	0	0	0	122.7
604	S	26.6	Very low	27.9	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	75%	0.747	S	S	*	*				79.8	120.8	123.2	-58.1	0	0	0	0	122.6
605	S	25.5	Very low	27.9	Very low	103 Å²	103	120.3 Å²	120.3	72%	0.72	75%	0.75	S	S	*	*				75	107.8	128.3	-58.1	0	0	0	0	121.9
606	S	25.3	Very low	28	Very low	106 Å²	106	122.4 Å²	122.4	74%	0.741	76%	0.758	S	S	*	*				73.6	127.8	114.1	-51.2	0	0	0	0	122.7
607	S	24.9	Very low	27.9	Very low	99 Å²	99	118.1 Å²	118.1	69%	0.692	75%	0.753	S	S	*	*				79.6	112.6	126.5	63	0	0	0	0	123
608	L	26	Very low	28	Very low	167 Å²	167	117.7 Å²	117.7	87%	0.874	76%	0.756	S	S	*	*				83.2	139.6	119.1	-69.1	173.4	0	0	0	123
609	S	24.9	Very low	27.9	Very low	95 Å²	95	119 Å²	119	66%	0.664	75%	0.754	S	S	*	*			trans	78.8	129	143.7	-158.1	0	0	0	0	120.4
610	C	23.4	Very low	27.9	Very low	114 Å²	114	121.5 Å²	121.5	77%	0.77	75%	0.753	S	S	*	*				174	114	119.4	-88.2	0	0	0	0	109.7
611	H	25.5	Very low	26.6	Very low	161 Å²	161	125.3 Å²	125.3	75%	0.745	76%	0.761	S	S	*	*				81.9	111.1	83.5	-106.5	-70.4	0	0	0	114.8
612	L	26.2	Very low	26.7	Very low	166 Å²	166	125.5 Å²	125.5	87%	0.869	77%	0.769	S	S	*	*				179.9	156.8	108.4	-96.6	159.9	0	0	0	114.8
613	Q	23.3	Very low	26.7	Very low	173 Å²	173	123.8 Å²	123.8	81%	0.808	77%	0.767	S	S	*	*			trans	-94	-174.9	172.4	-116.4	-176.4	-6.4	0	0	109.2
614	P	46.1	Very low	26.7	Very low	113 Å²	113	124.8 Å²	124.8	73%	0.734	77%	0.774	S	S	*	*			cis	-149.5	-176.8	29.2	44.2	-23.2	0	0	0	119.1
615	S	26.9	Very low	26.6	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	77%	0.771	S	S	*	*			trans	80.3	146.3	141.8	-173.1	0	0	0	0	121.3
616	V	26.7	Very low	26.6	Very low	134 Å²	134	126.9 Å²	126.9	81%	0.812	78%	0.783	S	S	*	*			cis	-170.1	146.3	-32	153.5	0	0	0	0	107
617	A	26	Very low	26.6	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	78%	0.778	S	S	*	*			trans	127.1	119.8	146.1	0	0	0	0	0	118.6
618	A	26.3	Very low	26.7	Very low	98 Å²	98	128.2 Å²	128.2	81%	0.81	79%	0.788	S	S	*	*			trans	57.9	156.4	140.2	0	0	0	0	0	120.6
619	L	25.7	Very low	26.8	Very low	144 Å²	144	125 Å²	125	75%	0.754	78%	0.779	S	S	*	*			cis	-154	152.4	-4.7	-159.2	68.9	0	0	0	110.5
620	E	25.8	Very low	26.7	Very low	164 Å²	164	128.7 Å²	128.7	77%	0.766	79%	0.788	S	S	*	*			trans	54.6	155.3	148.2	-90.5	172.9	165.5	0	0	126.7
621	E	26.5	Very low	26.7	Very low	191 Å²	191	126.8 Å²	126.8	89%	0.893	78%	0.776	S	S	*	*			trans	68.9	163	153	-72.9	-136.1	120.1	0	0	122.3
622	A	26.3	Very low	26.6	Very low	103 Å²	103	125.8 Å²	125.8	85%	0.851	78%	0.781	S	S	*	*			trans	-117.7	171.9	-159.3	0	0	0	0	0	112.2
623	G	26.2	Very low	26.5	Very low	68 Å²	68	121.5 Å²	121.5	70%	0.701	77%	0.765	S	S	*	*			trans	130.1	134	156.1	0	0	0	0	0	115.5
624	S	26.8	Very low	26.6	Very low	126 Å²	126	118.2 Å²	118.2	88%	0.881	75%	0.753	S	S	*	*			trans	43.9	137.8	140.5	-55.3	0	0	0	0	121.7
625	G	24.7	Very low	25.7	Very low	64 Å²	64	113.3 Å²	113.3	66%	0.66	72%	0.721	S	S	*	*			trans	-87.6	-163.4	166.1	0	0	0	0	0	113.7
626	L	25.9	Very low	25.8	Very low	187 Å²	187	114.8 Å²	114.8	98%	0.979	71%	0.712	S	S	*	*			trans	70	149.7	-171.2	-47.5	173.9	0	0	0	112.8
627	G	24	Very low	25.9	Very low	61 Å²	61	114.4 Å²	114.4	63%	0.629	71%	0.705	S	S	*	*			cis	149.6	98.5	-3.7	0	0	0	0	0	111.4
628	L	28.6	Very low	25.9	Very low	173 Å²	173	118 Å²	118	91%	0.906	71%	0.71	S	S	*	*			trans	-143.6	123.1	177.8	-61	171.5	0	0	0	107.4
629	S	26	Very low	26	Very low	98 Å²	98	116.1 Å²	116.1	69%	0.685	70%	0.701	S	S	*	*			cis	63.5	102.7	4.9	-158.8	0	0	0	0	116.7
630	M	24.2	Very low	26	Very low	173 Å²	173	118.3 Å²	118.3	85%	0.852	71%	0.707	S	S	*	*				167.2	158.7	113.9	-88.2	-175.2	77.8	0	0	110.8
631	S	23	Very low	26	Very low	74 Å²	74	114.2 Å²	114.2	52%	0.517	70%	0.701	S	S	.	*			cis	177.8	135.9	-43.5	53.6	0	0	0	0	109.9
632	V	23.8	Very low	25.9	Very low	140 Å²	140	110 Å²	110	85%	0.848	69%	0.692	S	S	*	*			trans	56.3	168.2	166.1	-102.5	0	0	0	0	116.5
633	S	24.5	Very low	26	Very low	77 Å²	77	112.8 Å²	112.8	54%	0.538	69%	0.693	S	S	.	*			cis	-155.4	-168.9	5	-142.9	0	0	0	0	111.8	P387	P387-S633 PolarHBondContact O-OG 2.75Å
634	N	24.4	Very low	25.9	Very low	104 Å²	104	116.3 Å²	116.3	56%	0.556	70%	0.701	S	S	*	*	B	Isolated β-bridge	trans	93.4	152.8	154.5	-67.8	1.3	0	0	0	120	E388 S389 H390	E388-N634 CarbonylContact O-C 3.33Å; E388-N634 WeakPolarHBondContact O-CA 3.5Å; E388-N634 PolarHBondContact O-N 3.45Å; S389-N634 VanDerWaalsContact CA-C 3.4Å; S389-N634 WeakPolarHBondContact CA-O 3.49Å; H390-N634 PolarHBondContact N-O 2.81Å
635	S	27.7	Very low	25.7	Very low	9 Å²	9	115.8 Å²	115.8	6%	0.063	69%	0.692	C	S	.	*			cis	-167.3	125.5	22.3	143.3	0	0	0	0	111.7	E388 S389 H390	E388-S635 WeakPolarHBondContact OE2-CB 3.45Å; E388-S635 PolarHBondContact OE2-OG 2.97Å; S389-S635 VanDerWaalsContact C-C 3.47Å; S389-S635 CarbonylContact C-O 3.2Å; S389-S635 VanDerWaalsContact N-N 3.17Å; H390-S635 WeakPolarHBondContact CB-O 3.42Å; H390-S635 PolarHBondContact N-O 2.89Å; H390-S635 PolarHBondContact ND1-O 2.99Å
636	Y	28.2	Very low	25.9	Very low	136 Å²	136	118.4 Å²	118.4	53%	0.533	70%	0.698	S	S	.	*			trans	80.7	126.8	166.6	-41.8	-57.2	0	0	0	120.7	E388 H390	E388-Y636 WeakPolarHBondContact OE2-CE1 3.35Å; H390-Y636 PolarHBondContact CE1-O 3.22Å; H390-Y636 VanDerWaalsContact CE1-O 3.28Å; H390-Y636 PolarHBondContact ND1-O 3.46Å
637	L	28.7	Very low	26.3	Very low	126 Å²	126	116 Å²	116	66%	0.66	69%	0.691	S	S	*	*				62.5	151.3	78.3	-55.2	175.6	0	0	0	114.1
638	I	27.3	Very low	26.7	Very low	162 Å²	162	118.1 Å²	118.1	83%	0.831	70%	0.696	S	S	*	*			cis	-160	169.1	12.1	-146.4	157.9	0	0	0	109
639	G	27	Very low	26.6	Very low	59 Å²	59	116.9 Å²	116.9	61%	0.608	69%	0.689	S	S	*	*			cis	169.2	161.1	-16.5	0	0	0	0	0	114.7
640	Q	26.5	Very low	26.9	Very low	189 Å²	189	117.7 Å²	117.7	88%	0.883	69%	0.686	S	S	*	*			trans	59	134.7	157.8	-54.1	-64.5	-21.1	0	0	120.3
641	A	25.2	Very low	27.2	Very low	78 Å²	78	117.1 Å²	117.1	65%	0.645	68%	0.681	S	S	*	*			cis	-163.5	154.1	-6.4	0	0	0	0	0	114.5
642	S	24.4	Very low	27.5	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	70%	0.695	S	S	*	*			trans	43.7	116.6	142.1	-58.1	0	0	0	0	125.3
643	L	29.9	Very low	27.7	Very low	163 Å²	163	117.1 Å²	117.1	85%	0.853	69%	0.687	S	S	*	*				43.4	116.8	122.8	-74.8	141	0	0	0	121.9
644	T	22.8	Very low	27.9	Very low	142 Å²	142	120.8 Å²	120.8	87%	0.871	70%	0.7	S	S	*	*			trans	-149.4	156.9	135.8	42.9	0	0	0	0	113.3
645	T	23.6	Very low	28.2	Very low	115 Å²	115	121 Å²	121	71%	0.706	71%	0.705	S	S	*	*			trans	-51.6	157	174.5	48.4	0	0	0	0	117.4
646	P	28.5	Very low	28.3	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	74%	0.74	S	S	*	*	S	Bend	trans	-74.4	157.5	146.8	34.8	-32.6	0	0	0	110.8
647	T	33.7	Very low	28.4	Very low	136 Å²	136	125.9 Å²	125.9	83%	0.834	75%	0.753	S	S	*	*			trans	88.6	108.6	178.4	-33.1	0	0	0	0	116
648	S	32	Very low	28.4	Very low	106 Å²	106	126 Å²	126	74%	0.741	76%	0.759	S	S	*	*			trans	-154.8	142.3	151.1	178.6	0	0	0	0	104.2
649	L	27.2	Very low	28.5	Very low	146 Å²	146	123.9 Å²	123.9	76%	0.764	75%	0.753	S	S	*	*	S	Bend	cis	-65.4	134.3	24.2	-92.3	59	0	0	0	118.3
650	D	32.5	Very low	28.5	Very low	115 Å²	115	128.6 Å²	128.6	62%	0.615	76%	0.764	S	S	*	*				56.7	139.7	126.9	-77	-44.7	0	0	0	122.4
651	Q	31	Very low	28.6	Very low	162 Å²	162	127.6 Å²	127.6	76%	0.757	76%	0.764	S	S	*	*			cis	-166.9	140.1	-0.6	-167.5	161.8	95.5	0	0	113.8
652	V	29	Very low	28.7	Very low	132 Å²	132	127.2 Å²	127.2	80%	0.8	77%	0.768	S	S	*	*			trans	77.6	120.4	148.8	160.1	0	0	0	0	125.3
653	A	27.9	Very low	28.8	Very low	82 Å²	82	128.6 Å²	128.6	68%	0.678	78%	0.777	S	S	*	*			trans	83.1	111.7	138.8	0	0	0	0	0	128.2
654	L	29	Very low	28.6	Very low	154 Å²	154	124.5 Å²	124.5	81%	0.806	78%	0.775	S	S	*	*				80.3	109.2	122.4	-70.2	167.4	0	0	0	126.4
655	T	29.3	Very low	28.7	Very low	108 Å²	108	122 Å²	122	66%	0.663	78%	0.777	S	S	*	*			trans	83.1	115	131.3	46.9	0	0	0	0	126.9
656	N	31.6	Very low	28.8	Very low	152 Å²	152	120 Å²	120	81%	0.813	78%	0.78	S	S	*	*				85.6	122.3	125.5	-65.6	0.1	0	0	0	126.2
657	A	29.2	Very low	29.6	Very low	96 Å²	96	119.7 Å²	119.7	79%	0.793	78%	0.777	S	S	*	*			trans	76.4	156.1	134.9	0	0	0	0	0	123.4
658	T	27.8	Very low	29.2	Very low	128 Å²	128	121 Å²	121	79%	0.785	78%	0.779	S	S	*	*			cis	-168.5	165	-38.7	-51	0	0	0	0	109.5
659	V	30	Very low	28.9	Very low	118 Å²	118	119.8 Å²	119.8	72%	0.715	78%	0.784	S	S	*	*			trans	99.9	108.3	152.5	-175.5	0	0	0	0	122.9
660	L	27.8	Very low	28.8	Very low	158 Å²	158	117.3 Å²	117.3	83%	0.827	78%	0.779	S	S	*	*				42.9	143.7	127.6	-50	175.9	0	0	0	128.6
661	D	28.7	Very low	28.4	Very low	167 Å²	167	118.9 Å²	118.9	89%	0.893	79%	0.786	S	S	*	*			trans	79.9	155.1	136.4	-122.1	-28.8	0	0	0	126
662	G	25.8	Very low	28.1	Very low	70 Å²	70	113.8 Å²	113.8	72%	0.722	77%	0.772	S	S	*	*			trans	142.9	139.4	162.5	0	0	0	0	0	117.7
663	S	26.9	Very low	27.9	Very low	131 Å²	131	108.2 Å²	108.2	92%	0.916	74%	0.741	S	S	*	*			trans	-143.3	149.6	-175.2	-179	0	0	0	0	115.8
664	G	25.8	Very low	27.8	Very low	77 Å²	77	107.6 Å²	107.6	79%	0.794	73%	0.732	S	S	*	*			trans	105.4	136.5	145	0	0	0	0	0	120.9
665	G	25.6	Very low	27.6	Very low	90 Å²	90	107.1 Å²	107.1	93%	0.928	73%	0.727	S	S	*	*			trans	109.9	142.7	148.5	0	0	0	0	0	120.1
666	G	25.9	Very low	27.4	Very low	73 Å²	73	105.1 Å²	105.1	75%	0.753	73%	0.728	S	S	*	*			trans	-138.5	-163.3	163.3	0	0	0	0	0	109.8
667	P	44.8	Very low	27	Very low	112 Å²	112	103.9 Å²	103.9	73%	0.727	73%	0.731	S	S	*	*			cis	-136.3	-161.8	4.2	43.1	-24.5	0	0	0	114.5
668	N	25.5	Very low	26.8	Very low	164 Å²	164	105.9 Å²	105.9	88%	0.877	73%	0.733	S	S	*	*			trans	74.5	138.9	161.7	-64.7	-13.9	0	0	0	120.8
669	G	25.7	Very low	26.7	Very low	81 Å²	81	103.7 Å²	103.7	84%	0.835	73%	0.728	S	S	*	*			trans	130	140.7	170.7	0	0	0	0	0	113.7
670	S	24.3	Very low	26.4	Very low	94 Å²	94	104.9 Å²	104.9	66%	0.657	74%	0.735	S	S	*	*			trans	-131.9	160.1	-171.4	-164	0	0	0	0	114.4
671	L	24.7	Very low	26.2	Very low	148 Å²	148	102.5 Å²	102.5	78%	0.775	73%	0.731	S	S	*	*			trans	72.5	104.2	167.5	-64.9	160.6	0	0	0	119.5
672	A	24.2	Very low	26	Very low	55 Å²	55	102.1 Å²	102.1	46%	0.455	73%	0.728	S	S	.	*				130.2	54.2	103.8	0	0	0	0	0	125.1	K33	K33-A672 HydrophobicContact CD-CB 3.91Å
673	G	25.3	Very low	26.1	Very low	14 Å²	14	104.6 Å²	104.6	14%	0.144	73%	0.731	C	S	.	*	B	Isolated β-bridge	trans	-117	135.4	152.5	0	0	0	0	0	119.9	K33 R34	K33-G673 CarbonylContact C-O 3.52Å; K33-G673 VanDerWaalsContact C-O 3.23Å; K33-G673 WeakPolarHBondContact CA-O 3.3Å; K33-G673 VanDerWaalsContact CB-O 3.23Å; K33-G673 WeakPolarHBondContact CB-O 3.4Å; K33-G673 WeakPolarHBondContact CG-O 3.36Å; R34-G673 WeakPolarHBondContact CB-O 3.26Å; R34-G673 VanDerWaalsContact CG-O 3.29Å; R34-G673 WeakPolarHBondContact CG-O 3.31Å; R34-G673 PolarHBondContact N-O 3.2Å; R34-G673 PolarHBondContact O-N 3.1Å
674	S	26.1	Very low	26	Very low	70 Å²	70	104 Å²	104	49%	0.49	73%	0.727	S	S	.	*			trans	-62.2	152.5	-172.9	-177.9	0	0	0	0	118.6	R34	R34-S674 VanDerWaalsContact CD-O 3.24Å; R34-S674 WeakPolarHBondContact CD-O 3.32Å; R34-S674 PolarHBondContact NE-O 3.4Å; R34-S674 PolarHBondContact NH1-O 3.38Å
675	M	24.7	Very low	25.9	Very low	143 Å²	143	109.8 Å²	109.8	70%	0.704	73%	0.733	S	S	*	*			trans	-170.1	164.6	133.4	-87.4	-70.5	76.5	0	0	108
676	G	25.3	Very low	25.9	Very low	66 Å²	66	110.8 Å²	110.8	68%	0.68	73%	0.726	S	S	*	*			cis	154.1	64.6	-3	0	0	0	0	0	111.7
677	S	23.2	Very low	25.8	Very low	126 Å²	126	112.3 Å²	112.3	88%	0.881	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-101	152.1	-177.4	-163.2	0	0	0	0	112.7
678	V	25.4	Very low	24.8	Very low	138 Å²	138	115.5 Å²	115.5	84%	0.836	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-78.7	132.3	-179.4	-179	0	0	0	0	110.1
679	A	23.9	Very low	24.8	Very low	83 Å²	83	113 Å²	113	69%	0.686	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-92.7	130.9	-179.2	0	0	0	0	0	111.8
680	V	24.5	Very low	24.7	Very low	142 Å²	142	115.9 Å²	115.9	86%	0.861	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-94.8	118.4	163.2	176.6	0	0	0	0	107.6
681	C	23.1	Very low	24.7	Very low	108 Å²	108	117.5 Å²	117.5	73%	0.73	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-89.4	124.5	-178	-61.5	0	0	0	0	111.6
682	L	24.8	Very low	24.7	Very low	159 Å²	159	118.5 Å²	118.5	83%	0.832	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-83.8	147.5	161	-70.8	171.6	0	0	0	109.9
683	P	27.7	Very low	24.7	Very low	122 Å²	122	123.5 Å²	123.5	79%	0.792	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.1	154.3	-175.9	31.6	-35.5	0	0	0	112.8
684	S	25.1	Very low	24.6	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-84	145.5	179.6	-46.2	0	0	0	0	112.5
685	E	23.5	Very low	24.5	Very low	198 Å²	198	131.5 Å²	131.5	93%	0.925	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.5	158.1	162.9	-61.1	-169.9	154.5	0	0	110.9
686	S	25.7	Very low	24.4	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	80%	0.797	S	S	*	*			trans	-129.7	122.2	179.8	58.5	0	0	0	0	110.8
687	S	24.6	Very low	24.3	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	81%	0.806	S	S	*	*			trans	-63.5	154.7	-174.3	-42.3	0	0	0	0	114.6
688	L	24.3	Very low	24.4	Very low	179 Å²	179	135.5 Å²	135.5	94%	0.937	81%	0.807	S	S	*	*			trans	-124.5	140.3	132.8	-78	175.1	0	0	0	108.3
689	T	23.7	Very low	24.4	Very low	111 Å²	111	134.1 Å²	134.1	68%	0.681	80%	0.803	S	S	*	*			trans	-133.4	164.2	174.8	51	0	0	0	0	108.6
690	D	24.2	Very low	24.4	Very low	142 Å²	142	136 Å²	136	76%	0.759	81%	0.806	S	S	*	*			trans	110.3	137.5	172.3	-65.2	6.5	0	0	0	113.4
691	L	25.3	Very low	24.5	Very low	128 Å²	128	135.8 Å²	135.8	67%	0.67	80%	0.8	S	S	*	*			cis	-167	144.8	-22.2	-130.5	167.5	0	0	0	107.3
692	L	24.9	Very low	24.7	Very low	169 Å²	169	136.6 Å²	136.6	89%	0.885	80%	0.797	S	S	*	*			trans	178.1	145	140.2	-99.9	167.4	0	0	0	111.1
693	H	23.6	Very low	24.8	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.745	80%	0.798	S	S	*	*			trans	-110.2	145.8	172.9	-68	-110.7	0	0	0	110
694	T	23.2	Very low	24.7	Very low	134 Å²	134	135.7 Å²	135.7	82%	0.822	80%	0.8	S	S	*	*			trans	-163.5	125	138.9	16.1	0	0	0	0	112.7
695	S	23	Very low	24.7	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	79%	0.79	S	S	*	*			trans	31.9	148.2	141.9	47.9	0	0	0	0	123.6
696	A	24	Very low	24.7	Very low	103 Å²	103	132.5 Å²	132.5	85%	0.851	79%	0.788	S	S	*	*			trans	-112.6	164.5	174	0	0	0	0	0	112.8
697	S	23.4	Very low	24.8	Very low	124 Å²	124	130.1 Å²	130.1	87%	0.867	78%	0.781	S	S	*	*			trans	-164.5	154.4	163	53.8	0	0	0	0	112.4
698	E	24.8	Very low	24.7	Very low	193 Å²	193	132.7 Å²	132.7	90%	0.902	78%	0.782	S	S	*	*			trans	-107.5	140.3	179.2	-57.2	161.2	110.6	0	0	112
699	S	24.8	Very low	24.7	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	77%	0.772	S	S	*	*			trans	177.2	132	153.2	52.5	0	0	0	0	108.8
700	V	24.4	Very low	24.7	Very low	122 Å²	122	132.5 Å²	132.5	74%	0.739	77%	0.768	S	S	*	*			cis	80.7	112.8	38.2	-178.4	0	0	0	0	113.1
701	N	26.5	Very low	24.6	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	76%	0.764	S	S	*	*			trans	67.7	152.2	159.9	-76.2	51.8	0	0	0	118.6
702	D	26.7	Very low	24.4	Very low	125 Å²	125	131.9 Å²	131.9	67%	0.668	77%	0.765	S	S	*	*			cis	-160.7	172	-14.2	-142.4	-21.5	0	0	0	112.5
703	E	26.6	Very low	24.3	Very low	181 Å²	181	133.3 Å²	133.3	85%	0.846	76%	0.76	S	S	*	*			trans	40.6	146.3	148.8	-100	-172.9	178.9	0	0	125.2
704	G	26	Very low	24.2	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	76%	0.757	S	S	*	*			trans	100.1	119.7	143.9	0	0	0	0	0	117.4
705	G	26.1	Very low	24.2	Very low	60 Å²	60	128.4 Å²	128.4	62%	0.619	75%	0.749	S	S	*	*			cis	167.4	171.9	-4.3	0	0	0	0	0	112.1
706	E	24.1	Very low	24.2	Very low	189 Å²	189	127.2 Å²	127.2	88%	0.883	74%	0.741	S	S	*	*			trans	53.8	130.9	157.5	-32	-47.9	94.6	0	0	119.7
707	G	25.8	Very low	24.2	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	74%	0.742	S	S	*	*			cis	169.1	176.5	-3.6	0	0	0	0	0	112.4
708	E	24.4	Very low	24.2	Very low	157 Å²	157	128.9 Å²	128.9	73%	0.734	73%	0.73	S	S	*	*			trans	59.2	149.4	151.1	-55.8	-165	142.6	0	0	119.7
709	Y	23.5	Very low	24	Very low	189 Å²	189	127.7 Å²	127.7	74%	0.741	73%	0.73	S	S	*	*			cis	-168.7	165.1	-10.3	-108.1	178	0	0	0	108.4
710	V	23.6	Very low	23.9	Very low	97 Å²	97	125.7 Å²	125.7	59%	0.588	73%	0.726	S	S	*	*			cis	-175	161.8	-32.3	72.8	0	0	0	0	109
711	N	21.7	Very low	23.7	Very low	129 Å²	129	129 Å²	129	69%	0.69	73%	0.733	S	S	*	*			trans	67.1	155.9	165	-68.6	-10.8	0	0	0	119.1
712	L	22.3	Very low	23.5	Very low	129 Å²	129	130.2 Å²	130.2	68%	0.675	74%	0.739	S	S	*	*			cis	-164.1	156.9	-25.5	-108.8	176.5	0	0	0	111.1
713	Y	21.6	Very low	23.6	Very low	199 Å²	199	129.3 Å²	129.3	78%	0.78	74%	0.74	S	S	*	*			trans	63.5	137.7	150.7	-94.7	-67.1	0	0	0	124.3
714	S	22.3	Very low	23.4	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	74%	0.738	S	S	*	*			trans	79.8	148.7	141.8	-79.5	0	0	0	0	120.8
715	S	22.9	Very low	23.2	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	73%	0.731	S	S	*	*			cis	-173	159.1	-20.6	-99.7	0	0	0	0	110.1
716	S	23.3	Very low	23	Very low	93 Å²	93	134.2 Å²	134.2	65%	0.65	75%	0.745	S	S	*	*			trans	75.3	126.3	155.9	-56.3	0	0	0	0	121.1
717	Q	22.9	Very low	22.9	Very low	187 Å²	187	134.7 Å²	134.7	87%	0.874	74%	0.738	S	S	*	*				55.9	148.5	124	-59.8	174.9	19	0	0	121.1
718	A	23.5	Very low	22.8	Very low	74 Å²	74	137.5 Å²	137.5	61%	0.612	74%	0.735	S	S	*	*			cis	-172.8	160.8	-16.9	0	0	0	0	0	109.5
719	N	21.5	Very low	23	Very low	169 Å²	169	136 Å²	136	90%	0.904	74%	0.736	S	S	*	*			trans	64.7	155	173.3	-51.7	-10.4	0	0	0	115.4
720	G	21.5	Very low	23.1	Very low	66 Å²	66	135.3 Å²	135.3	68%	0.68	74%	0.743	S	S	*	*			cis	171.4	156.2	-8.1	0	0	0	0	0	111.7
721	E	22	Very low	23.5	Very low	191 Å²	191	135.3 Å²	135.3	89%	0.893	75%	0.754	S	S	*	*			trans	70.4	121	169.1	-56.7	-176.5	162.5	0	0	120
722	L	20.8	Very low	24	Very low	164 Å²	164	132.9 Å²	132.9	86%	0.859	75%	0.751	S	S	*	*			trans	18.9	153.2	130.2	-62.2	169.3	0	0	0	120.4
723	P	29.5	Very low	24.4	Very low	107 Å²	107	134.1 Å²	134.1	70%	0.695	76%	0.759	S	S	*	*			cis	-150.7	176.9	31.4	44.1	-23.7	0	0	0	119.4
724	L	22	Very low	24.9	Very low	155 Å²	155	131 Å²	131	81%	0.812	76%	0.756	S	S	*	*			trans	41	115.4	142	-66.3	169.3	0	0	0	123.3
725	S	22.1	Very low	25.4	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	76%	0.756	S	S	*	*			trans	2.8	137.4	137.9	61.8	0	0	0	0	122.4
726	L	21.3	Very low	26	Very low	171 Å²	171	134.2 Å²	134.2	90%	0.895	76%	0.761	S	S	*	*				-157.9	151.8	120.5	-149	70	0	0	0	114.6
727	R	22.1	Very low	26.3	Very low	199 Å²	199	137.8 Å²	137.8	75%	0.751	77%	0.767	S	S	*	*			trans	-64.6	167.3	158.9	-133.5	163.2	120.6	163.3	-0.6	109
728	E	23.9	Very low	26.4	Very low	123 Å²	123	135 Å²	135	58%	0.575	76%	0.759	S	S	*	*			cis	-175.3	157.5	24.6	-166.4	155.7	-148.8	0	0	111.3
729	T	29.5	Very low	27.1	Very low	124 Å²	124	137.5 Å²	137.5	76%	0.761	77%	0.768	S	S	*	*			trans	54	144.5	154.3	45.7	0	0	0	0	124
730	I	25.8	Very low	27.3	Very low	175 Å²	175	135 Å²	135	90%	0.897	76%	0.759	S	S	*	*			trans	-156.7	156.3	154	29	168.1	0	0	0	107.5
731	A	30.8	Very low	28.3	Very low	97 Å²	97	137.1 Å²	137.1	80%	0.802	76%	0.761	S	S	*	*			cis	-136.3	-158.4	-3.8	0	0	0	0	0	107.8
732	A	32	Very low	28.3	Very low	78 Å²	78	136.2 Å²	136.2	65%	0.645	76%	0.756	S	S	*	*			cis	-148.3	-139.3	2.6	0	0	0	0	0	107.5
733	D	31.8	Very low	28.5	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	76%	0.755	S	S	*	*			cis	-169.8	163	-8.7	-111.1	-19.9	0	0	0	103.9
734	D	32	Very low	28.7	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	75%	0.754	S	S	*	*			cis	-162.9	-178.2	-28.8	-179.3	29.7	0	0	0	106.2
735	V	32.5	Very low	28.8	Very low	112 Å²	112	133.9 Å²	133.9	68%	0.679	75%	0.75	S	S	*	*			trans	71.7	134.1	164	177	0	0	0	0	116.4
736	L	35.9	Very low	29	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	75%	0.753	S	S	*	*			cis	-162.1	-173.1	-18.9	-101.7	-175.6	0	0	0	104.8
737	Q	29.5	Very low	29.2	Very low	169 Å²	169	133.6 Å²	133.6	79%	0.79	75%	0.75	S	S	*	*			cis	-145.2	-89.2	10.9	-159.5	176.1	6.1	0	0	113
738	D	23.6	Very low	29.5	Very low	129 Å²	129	130.1 Å²	130.1	69%	0.69	76%	0.756	S	S	*	*			trans	-161.5	170.5	-165.2	-119.3	-31.8	0	0	0	109.2
739	P	38.6	Very low	29.7	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	77%	0.765	S	S	*	*			cis	-134.7	176.5	32.2	40.4	-21.5	0	0	0	118
740	V	26.3	Very low	29.5	Very low	118 Å²	118	133.6 Å²	133.6	72%	0.715	76%	0.761	S	S	*	*			trans	-123.8	151.1	-175.2	-174	0	0	0	0	111.7
741	P	42.2	Very low	29.7	Very low	109 Å²	109	129.7 Å²	129.7	71%	0.708	76%	0.755	S	S	*	*				-153.1	133.5	120.7	34.6	-15.1	0	0	0	118.3
742	Q	22.3	Very low	29.6	Very low	172 Å²	172	133.5 Å²	133.5	80%	0.804	76%	0.761	S	S	*	*			trans	56.7	122.5	132.3	-58.8	175.1	9.8	0	0	120.9
743	M	25.4	Very low	29.5	Very low	170 Å²	170	136.2 Å²	136.2	84%	0.837	77%	0.765	S	S	*	*				73	152.8	69.9	-67.9	-67.4	-78.2	0	0	114.5
744	P	34	Very low	29.4	Very low	103 Å²	103	138.6 Å²	138.6	67%	0.669	77%	0.768	S	S	*	*			cis	-146	-177.8	21.4	42	-20.9	0	0	0	119.3
745	S	23.7	Very low	29.3	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	78%	0.778	S	S	*	*			trans	61.7	149.1	147.9	58.5	0	0	0	0	122.4
746	S	25.1	Very low	29.5	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	79%	0.786	S	S	*	*			cis	-168.2	140.9	-14.4	51.2	0	0	0	0	113.4
747	N	26.9	Very low	29.4	Very low	157 Å²	157	151 Å²	151	84%	0.84	79%	0.791	S	S	*	*			trans	41	116.1	154.5	-65	2	0	0	0	122.3
748	S	27.3	Very low	29.5	Very low	126 Å²	126	150 Å²	150	88%	0.881	79%	0.786	S	S	*	*				-160.8	161.9	117.5	11.7	0	0	0	0	113.2
749	K	28	Very low	29.9	Very low	173 Å²	173	153.5 Å²	153.5	75%	0.752	80%	0.795	S	S	*	*			trans	-46.7	160.2	171.9	-71.4	158	159.7	-95.8	0	113.9
750	E	26.3	Very low	29.7	Very low	147 Å²	147	154.2 Å²	154.2	69%	0.687	80%	0.798	S	S	*	*			cis	-159.5	169.9	8.8	-131.4	139.7	-148.5	0	0	111.4
751	A	29.3	Very low	30.1	Very low	93 Å²	93	151.7 Å²	151.7	77%	0.769	79%	0.789	S	S	*	*	S	Bend	trans	56.6	70.4	156.3	0	0	0	0	0	120
752	L	29.8	Very low	29.6	Very low	178 Å²	178	154.6 Å²	154.6	93%	0.932	79%	0.793	S	S	*	*			trans	-164.6	55.1	147.1	-116.2	170.4	0	0	0	112.5
753	D	29.9	Very low	30.3	Very low	134 Å²	134	153.3 Å²	153.3	72%	0.717	80%	0.797	S	S	*	*			trans	-141.8	71.8	-172.6	-148.7	-13.2	0	0	0	113.5
754	K	28.7	Very low	30.9	Very low	206 Å²	206	149.7 Å²	149.7	90%	0.896	80%	0.795	S	S	*	*	S	Bend	trans	-146	22.2	163.7	-132.3	-176.6	-177.5	-169	0	115.7
755	E	30.3	Very low	30.6	Very low	200 Å²	200	148.8 Å²	148.8	94%	0.935	80%	0.804	S	S	*	*	S	Bend	trans	-122.3	25.3	169.9	-147.7	-173.7	148.7	0	0	112.6
756	R	36	Very low	31	Very low	224 Å²	224	148.8 Å²	148.8	85%	0.845	80%	0.804	S	S	*	*	S	Bend	trans	-133.5	13.6	172.5	-152.5	171.8	177.8	166.3	1.1	114.5
757	R	33.3	Very low	31.4	Very low	227 Å²	227	150.3 Å²	150.3	86%	0.857	81%	0.808	S	S	*	*	S	Bend	trans	-132.4	34.4	179	-94.6	-171.4	169.4	-173.1	-3.2	115.1
758	Q	32.3	Very low	32.1	Very low	150 Å²	150	151.1 Å²	151.1	70%	0.701	81%	0.807	S	S	*	*	S	Bend	trans	-150.3	62.6	156	-131.6	160.6	-38.1	0	0	110.6	A761	Q758-A761 HydrophobicContact CG-CB 4.41Å
759	K	32.8	Very low	32.9	Very low	202 Å²	202	152.8 Å²	152.8	88%	0.878	80%	0.801	S	S	*	*	S	Bend	trans	-130.7	30.9	169.8	-148.4	164.1	-170.3	167.9	0	112
760	T	34.9	Very low	34.4	Very low	140 Å²	140	152.8 Å²	152.8	86%	0.859	81%	0.809	S	S	*	*	S	Bend	trans	-160.9	44.3	178	32.3	0	0	0	0	109.7
761	A	34.3	Very low	37	Very low	65 Å²	65	148.3 Å²	148.3	54%	0.537	79%	0.792	S	S	.	*	S	Bend	trans	-164.2	39.2	176.1	0	0	0	0	0	113.7	Q758	Q758-A761 HydrophobicContact CG-CB 4.41Å
762	E	30.5	Very low	39.9	Very low	169 Å²	169	146.6 Å²	146.6	79%	0.79	77%	0.769	S	S	*	*			trans	-161.1	75.3	166.7	-109.8	147.8	-120.8	0	0	108.4
763	T	37.2	Very low	43	Very low	145 Å²	145	140.1 Å²	140.1	89%	0.89	74%	0.735	S	S	*	*			trans	-139.8	60	174.5	-49	0	0	0	0	107
764	A	38.6	Very low	46.1	Very low	95 Å²	95	134.3 Å²	134.3	79%	0.785	70%	0.703	S	S	*	*			trans	-158.8	114.6	-177.5	0	0	0	0	0	108.9
765	G	28.2	Very low	49.2	Very low	84 Å²	84	126.5 Å²	126.5	87%	0.866	68%	0.675	S	S	*	*	S	Bend	trans	89.4	115.6	-173.6	0	0	0	0	0	112.6
766	S	31.9	Very low	52.3	Low	104 Å²	104	117.3 Å²	117.3	73%	0.727	63%	0.632	S	S	*	*			cis	-131.8	128.3	-10.4	47.1	0	0	0	0	109.3	E768	S766-E768 PolarHBondContact O-N 2.87Å
767	V	32.6	Very low	54.9	Low	137 Å²	137	108 Å²	108	83%	0.83	60%	0.599	S	S	*	*			trans	-80.3	100.3	164.1	179.6	0	0	0	0	105.9	E769	V767-E769 PolarHBondContact O-N 3.47Å
768	E	42.4	Very low	57.7	Low	175 Å²	175	101.8 Å²	101.8	82%	0.818	58%	0.583	S	S	*	*			trans	-70	122.6	153.2	-63.9	-161.1	165.2	0	0	106.3	S766 D770	S766-E768 PolarHBondContact O-N 2.87Å; E768-D770 PolarHBondContact O-N 3.4Å
769	E	43.9	Very low	60.5	Low	161 Å²	161	98.2 Å²	98.2	75%	0.752	57%	0.566	S	S	*	*			trans	-64.9	133.1	168.6	-63.6	-175.6	144.6	0	0	107.3	V767 V771	V767-E769 PolarHBondContact O-N 3.47Å; E769-V771 HydrophobicContact CB-CG2 4.02Å; E769-V771 WeakPolarHBondContact O-CG2 3.29Å; E769-V771 PolarHBondContact O-N 3.02Å
770	D	59.5	Low	63.4	Low	173 Å²	173	96.8 Å²	96.8	93%	0.925	56%	0.559	S	S	*	*			trans	-75.7	70.4	-179.7	-162.8	11.9	0	0	0	109.1	E768 D772	E768-D770 PolarHBondContact O-N 3.4Å; D770-D772 PolarHBondContact O-N 3.18Å
771	V	79.8	Confident	66.2	Low	52 Å²	52	93.4 Å²	93.4	32%	0.315	53%	0.534	S	S	.	.			trans	-71.9	110.1	-171.6	176.1	0	0	0	0	109.3	E769 E773 L776 R785	E769-V771 HydrophobicContact CB-CG2 4.02Å; E769-V771 WeakPolarHBondContact O-CG2 3.29Å; E769-V771 PolarHBondContact O-N 3.02Å; V771-E773 PolarHBondContact O-N 3.3Å; V771-L776 HydrophobicContact CG1-CD2 3.97Å; V771-R785 VanDerWaalsContact CG1-NH2 3.29Å
772	D	91.9	Very high	69	Low	57 Å²	57	90.4 Å²	90.4	31%	0.305	51%	0.509	S	S	.	.			trans	-48.8	104.2	173.4	168.3	33.6	0	0	0	111.6	D770 L774 S775 Y844	D770-D772 PolarHBondContact O-N 3.18Å; D772-L774 PolarHBondContact O-N 2.94Å; D772-L774 WeakPolarHBondContact OD1-CB 3.37Å; D772-L774 PolarHBondContact OD1-N 3.32Å; D772-S775 WeakPolarHBondContact O-CB 3.28Å; D772-S775 PolarHBondContact O-N 3.19Å; D772-S775 PolarHBondContact O-OG 3.25Å; D772-S775 VanDerWaalsContact OD2-CB 3.29Å; D772-S775 WeakPolarHBondContact OD2-CB 3.39Å; D772-S775 PolarHBondContact OD2-N 2.99Å; D772-Y844 WeakPolarHBondContact OD2-CE1 3.49Å; D772-Y844 PolarHBondContact OD2-OH 3.48Å
773	E	93.9	Very high	72	Confident	43 Å²	43	84.6 Å²	84.6	20%	0.201	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-62.2	-30.3	-178.1	-58.7	-160	133.6	0	0	111.8	V771 S775 L776 R785 S802 D804 V808	V771-E773 PolarHBondContact O-N 3.3Å; E773-S775 PolarHBondContact O-N 2.64Å; E773-L776 HydrophobicContact CB-CD1 4.26Å; E773-L776 HydrophobicContact CG-CD1 4.48Å; E773-L776 VanDerWaalsContact O-CB 3.32Å; E773-L776 WeakPolarHBondContact O-CB 3.31Å; E773-L776 WeakPolarHBondContact O-CG 3.3Å; E773-L776 PolarHBondContact O-N 3.38Å; E773-R785 VanDerWaalsContact OE1-CD 3.29Å; E773-R785 WeakPolarHBondContact OE1-CD 3.32Å; E773-R785 IonicContact OE1-NH1 2.71Å; E773-R785 PolarHBondContact OE1-NH1 3.21Å; E773-R785 VanDerWaalsContact OE1-NH1 3.16Å; E773-S802 VanDerWaalsContact OE2-CB 3.31Å; E773-S802 WeakPolarHBondContact OE2-CB 3.44Å; E773-S802 PolarHBondContact OE2-OG 3.28Å; E773-D804 HydrophobicContact CB-CB 3.93Å; E773-V808 WeakPolarHBondContact O-CG2 3.45Å
774	L	95.1	Very high	74.7	Confident	11 Å²	11	81.9 Å²	81.9	6%	0.058	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-69.9	-13.9	178.2	-61.6	175.4	0	0	0	112.7	D772 D804 L807 V808 K841 Y844 R845	D772-L774 PolarHBondContact O-N 2.94Å; D772-L774 WeakPolarHBondContact OD1-CB 3.37Å; D772-L774 PolarHBondContact OD1-N 3.32Å; L774-D804 WeakPolarHBondContact CD1-OD1 3.47Å; L774-D804 HydrophobicContact CD2-CB 3.97Å; L774-D804 WeakPolarHBondContact CD2-OD1 3.3Å; L774-D804 HydrophobicContact CG-CB 4.23Å; L774-D804 WeakPolarHBondContact CG-OD1 3.42Å; L774-L807 HydrophobicContact CD2-CD1 4.15Å; L774-L807 HydrophobicContact CD2-CD2 3.89Å; L774-V808 HydrophobicContact CD2-CG2 4.21Å; L774-K841 HydrophobicContact CD1-CB 3.9Å; L774-K841 HydrophobicContact CD1-CD 4.28Å; L774-K841 HydrophobicContact CD1-CG 3.84Å; L774-K841 HydrophobicContact CD2-CB 4.38Å; L774-Y844 HydrophobicContact CB-CD1 3.85Å; L774-Y844 HydrophobicContact CB-CE1 3.95Å; L774-Y844 HydrophobicContact CD1-CD1 3.76Å; L774-Y844 HydrophobicContact CD1-CE1 4.36Å; L774-Y844 HydrophobicContact CG-CD1 4.47Å; L774-R845 WeakPolarHBondContact O-CG 3.49Å; L774-R845 PolarHBondContact O-NH1 2.98Å
775	S	94.4	Very high	77.4	Confident	42 Å²	42	80.1 Å²	80.1	29%	0.294	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-85.7	-5.9	170.7	76.7	0	0	0	0	114.7	D772 E773 I777 F849	D772-S775 WeakPolarHBondContact O-CB 3.28Å; D772-S775 PolarHBondContact O-N 3.19Å; D772-S775 PolarHBondContact O-OG 3.25Å; D772-S775 VanDerWaalsContact OD2-CB 3.29Å; D772-S775 WeakPolarHBondContact OD2-CB 3.39Å; D772-S775 PolarHBondContact OD2-N 2.99Å; E773-S775 PolarHBondContact O-N 2.64Å; S775-I777 VanDerWaalsContact O-CG1 3.26Å; S775-I777 WeakPolarHBondContact O-CG1 3.43Å; S775-F849 WeakPolarHBondContact O-CZ 3.4Å
776	L	94.5	Very high	80.6	Confident	7 Å²	7	76.6 Å²	76.6	4%	0.037	40%	0.403	C	S	.	.			trans	-76.2	143	-172.8	-61.1	179	0	0	0	113.6	V771 E773 E781 I782 I805 V808 R845	V771-L776 HydrophobicContact CG1-CD2 3.97Å; E773-L776 HydrophobicContact CB-CD1 4.26Å; E773-L776 HydrophobicContact CG-CD1 4.48Å; E773-L776 VanDerWaalsContact O-CB 3.32Å; E773-L776 WeakPolarHBondContact O-CB 3.31Å; E773-L776 WeakPolarHBondContact O-CG 3.3Å; E773-L776 PolarHBondContact O-N 3.38Å; L776-E781 HydrophobicContact CD2-CG 4.5Å; L776-E781 VanDerWaalsContact CD2-OE1 3.3Å; L776-E781 WeakPolarHBondContact CD2-OE1 3.3Å; L776-E781 WeakPolarHBondContact CD2-OE2 3.32Å; L776-I782 HydrophobicContact CB-CG1 4.02Å; L776-I805 HydrophobicContact CD1-CD1 3.78Å; L776-V808 HydrophobicContact CB-CG1 4.27Å; L776-R845 PolarHBondContact O-NH1 2.96Å; L776-R845 PolarHBondContact O-NH2 2.99Å; L776-R845 VanDerWaalsContact O-NH2 3.08Å
777	I	92	Very high	83.6	Confident	30 Å²	30	73.5 Å²	73.5	15%	0.154	38%	0.38	C	S	.	.			trans	-146.2	-19.3	-174.5	-16.7	-178	0	0	0	114	S775 H779 F849 F856 K857 V860	S775-I777 VanDerWaalsContact O-CG1 3.26Å; S775-I777 WeakPolarHBondContact O-CG1 3.43Å; I777-H779 PolarHBondContact O-N 3.32Å; I777-F849 HydrophobicContact CD1-CD1 4.15Å; I777-F849 HydrophobicContact CD1-CE1 3.45Å; I777-F849 VanDerWaalsContact CD1-CE1 3.45Å; I777-F849 HydrophobicContact CD1-CE2 4.37Å; I777-F849 HydrophobicContact CD1-CZ 3.58Å; I777-F849 HydrophobicContact CG1-CE1 4.12Å; I777-F849 HydrophobicContact CG1-CE2 4.5Å; I777-F849 HydrophobicContact CG1-CZ 3.76Å; I777-F856 HydrophobicContact CB-CE1 4.31Å; I777-F856 HydrophobicContact CG2-CD1 4.2Å; I777-F856 HydrophobicContact CG2-CE1 3.54Å; I777-F856 HydrophobicContact CG2-CZ 4.26Å; I777-K857 HydrophobicContact CD1-CD 4Å; I777-K857 HydrophobicContact CD1-CG 3.59Å; I777-V860 HydrophobicContact CG2-CB 4.37Å; I777-V860 HydrophobicContact CG2-CG1 4.28Å; I777-V860 HydrophobicContact CG2-CG2 3.69Å
778	D	91.5	Very high	86.6	Confident	96 Å²	96	70.7 Å²	70.7	51%	0.513	36%	0.36	S	S	.	.			trans	-75.8	125	172.6	178.3	70.7	0	0	0	110	K780 E781 I782	D778-K780 VanDerWaalsContact C-N 3.31Å; D778-K780 PolarHBondContact O-N 3.39Å; D778-K780 WeakPolarHBondContact OD2-CA 3.34Å; D778-K780 VanDerWaalsContact OD2-CB 3.26Å; D778-K780 WeakPolarHBondContact OD2-CB 3.35Å; D778-K780 PolarHBondContact OD2-N 2.99Å; D778-E781 HydrophobicContact CB-CB 4.25Å; D778-E781 PolarHBondContact O-N 2.78Å; D778-E781 PolarHBondContact OD2-N 3.14Å; D778-I782 WeakPolarHBondContact O-CD1 3.42Å; D778-I782 VanDerWaalsContact O-CG1 3.24Å; D778-I782 WeakPolarHBondContact O-CG1 3.29Å; D778-I782 PolarHBondContact O-N 3.01Å
779	H	91.7	Very high	89	Confident	75 Å²	75	66 Å²	66	35%	0.347	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-34.4	-176.3	175.7	72.2	0	0	0	112.4	I777 I782 M783 E812 R815	I777-H779 PolarHBondContact O-N 3.32Å; H779-I782 PolarHBondContact O-N 2.94Å; H779-M783 WeakPolarHBondContact CE1-CG 3.4Å; H779-M783 WeakPolarHBondContact O-CB 3.45Å; H779-M783 WeakPolarHBondContact O-CG 3.32Å; H779-M783 PolarHBondContact O-N 3.25Å; H779-E812 IonicContact CE1-OE2 2.73Å; H779-E812 IonicContact CG-OE2 3.2Å; H779-E812 IonicContact ND1-OE1 3.73Å; H779-E812 PolarHBondContact ND1-OE1 2.96Å; H779-E812 IonicContact ND1-OE2 3.37Å; H779-E812 PolarHBondContact ND1-OE2 3.05Å; H779-R815 PolarHBondContact CE1-NE 3.29Å; H779-R815 PolarHBondContact ND1-NE 3.03Å
780	K	91.8	Very high	91.1	Very high	171 Å²	171	64.5 Å²	64.5	74%	0.743	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-39.9	179	-175	-174.5	176.3	-174.1	0	110.8	D778 S784	D778-K780 VanDerWaalsContact C-N 3.31Å; D778-K780 PolarHBondContact O-N 3.39Å; D778-K780 WeakPolarHBondContact OD2-CA 3.34Å; D778-K780 VanDerWaalsContact OD2-CB 3.26Å; D778-K780 WeakPolarHBondContact OD2-CB 3.35Å; D778-K780 PolarHBondContact OD2-N 2.99Å; K780-S784 WeakPolarHBondContact O-CB 3.38Å; K780-S784 PolarHBondContact O-N 3.5Å
781	E	94.1	Very high	92.3	Very high	70 Å²	70	65.6 Å²	65.6	33%	0.327	33%	0.33	S	S	.	.	H	α-helix	trans	-64.7	-47.1	172.6	-166.7	-177.9	169.6	0	0	111.6	L776 D778 M783 S784 R785	L776-E781 HydrophobicContact CD2-CG 4.5Å; L776-E781 VanDerWaalsContact CD2-OE1 3.3Å; L776-E781 WeakPolarHBondContact CD2-OE1 3.3Å; L776-E781 WeakPolarHBondContact CD2-OE2 3.32Å; D778-E781 HydrophobicContact CB-CB 4.25Å; D778-E781 PolarHBondContact O-N 2.78Å; D778-E781 PolarHBondContact OD2-N 3.14Å; E781-M783 VanDerWaalsContact C-N 3.34Å; E781-M783 PolarHBondContact O-N 3.13Å; E781-S784 WeakPolarHBondContact O-CB 3.4Å; E781-S784 PolarHBondContact O-N 3.15Å; E781-S784 PolarHBondContact O-OG 3.23Å; E781-R785 PolarHBondContact O-N 3.41Å; E781-R785 IonicContact OE1-CZ 2.73Å; E781-R785 IonicContact OE1-NE 3.93Å; E781-R785 PolarHBondContact OE1-NE 2.77Å; E781-R785 IonicContact OE1-NH2 3.16Å; E781-R785 PolarHBondContact OE1-NH2 3.03Å
782	I	93.7	Very high	92.5	Very high	1 Å²	1	70.7 Å²	70.7	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-56.6	-49.2	179.1	-66	162.5	0	0	0	110.8	L776 D778 H779 S784 R785 I786 I805 V808 H809 E812	L776-I782 HydrophobicContact CB-CG1 4.02Å; D778-I782 WeakPolarHBondContact O-CD1 3.42Å; D778-I782 VanDerWaalsContact O-CG1 3.24Å; D778-I782 WeakPolarHBondContact O-CG1 3.29Å; D778-I782 PolarHBondContact O-N 3.01Å; H779-I782 PolarHBondContact O-N 2.94Å; I782-S784 VanDerWaalsContact C-N 3.29Å; I782-S784 PolarHBondContact O-N 3.16Å; I782-R785 PolarHBondContact O-N 3.24Å; I782-I786 HydrophobicContact CG2-CD1 4.08Å; I782-I786 PolarHBondContact O-N 3.29Å; I782-I805 HydrophobicContact CB-CD1 4.47Å; I782-I805 HydrophobicContact CG2-CD1 4.12Å; I782-I805 HydrophobicContact CG2-CG1 4.18Å; I782-V808 HydrophobicContact CD1-CG1 3.57Å; I782-V808 HydrophobicContact CG1-CG1 3.63Å; I782-V808 HydrophobicContact CG2-CG1 4.05Å; I782-H809 HydrophobicContact CG2-CB 4.47Å; I782-E812 HydrophobicContact CD1-CG 4.17Å; I782-E812 WeakPolarHBondContact CG2-OE1 3.39Å
783	M	93.3	Very high	92.1	Very high	48 Å²	48	70.7 Å²	70.7	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-27.3	178.2	-65.8	-60.4	-75.8	0	0	113.3	H779 E781 R785 I786 L788 H809	H779-M783 WeakPolarHBondContact CE1-CG 3.4Å; H779-M783 WeakPolarHBondContact O-CB 3.45Å; H779-M783 WeakPolarHBondContact O-CG 3.32Å; H779-M783 PolarHBondContact O-N 3.25Å; E781-M783 VanDerWaalsContact C-N 3.34Å; E781-M783 PolarHBondContact O-N 3.13Å; M783-R785 VanDerWaalsContact C-N 3.29Å; M783-R785 PolarHBondContact O-N 3.3Å; M783-I786 PolarHBondContact O-N 3.44Å; M783-I786 HydrophobicContact SD-CD1 4.05Å; M783-L788 HydrophobicContact CE-CD1 4.29Å; M783-L788 HydrophobicContact CE-CD2 3.75Å; M783-H809 PolarHBondContact SD-CE1 3.11Å
784	S	94.8	Very high	91.6	Very high	88 Å²	88	76.9 Å²	76.9	62%	0.615	39%	0.39	S	S	*	.	H	α-helix	trans	-68.7	-25.7	176.4	77.4	0	0	0	0	113.6	K780 E781 I782	K780-S784 WeakPolarHBondContact O-CB 3.38Å; K780-S784 PolarHBondContact O-N 3.5Å; E781-S784 WeakPolarHBondContact O-CB 3.4Å; E781-S784 PolarHBondContact O-N 3.15Å; E781-S784 PolarHBondContact O-OG 3.23Å; I782-S784 VanDerWaalsContact C-N 3.29Å; I782-S784 PolarHBondContact O-N 3.16Å
785	R	94.9	Very high	91	Very high	58 Å²	58	78.2 Å²	78.2	22%	0.219	41%	0.406	C	S	.	.	H	α-helix	trans	-89.8	-19.7	178.3	-62	-175.7	-174.2	-135.4	6.1	112.5	V771 E773 E781 I782 M783 I805 K1112	V771-R785 VanDerWaalsContact CG1-NH2 3.29Å; E773-R785 VanDerWaalsContact OE1-CD 3.29Å; E773-R785 WeakPolarHBondContact OE1-CD 3.32Å; E773-R785 IonicContact OE1-NH1 2.71Å; E773-R785 PolarHBondContact OE1-NH1 3.21Å; E773-R785 VanDerWaalsContact OE1-NH1 3.16Å; E781-R785 PolarHBondContact O-N 3.41Å; E781-R785 IonicContact OE1-CZ 2.73Å; E781-R785 IonicContact OE1-NE 3.93Å; E781-R785 PolarHBondContact OE1-NE 2.77Å; E781-R785 IonicContact OE1-NH2 3.16Å; E781-R785 PolarHBondContact OE1-NH2 3.03Å; I782-R785 PolarHBondContact O-N 3.24Å; M783-R785 VanDerWaalsContact C-N 3.29Å; M783-R785 PolarHBondContact O-N 3.3Å; R785-I805 HydrophobicContact CB-CD1 4.02Å; R785-I805 HydrophobicContact CB-CG1 3.91Å; R785-K1112 PolarHBondContact O-NZ 3.48Å
786	I	95.3	Very high	90.7	Very high	9 Å²	9	76.7 Å²	76.7	5%	0.046	40%	0.395	C	S	.	.	S	Bend	trans	-78.7	132.1	173.6	-68.9	168.7	0	0	0	110.3	I782 M783 L788 V798 I805 H809	I782-I786 HydrophobicContact CG2-CD1 4.08Å; I782-I786 PolarHBondContact O-N 3.29Å; M783-I786 PolarHBondContact O-N 3.44Å; M783-I786 HydrophobicContact SD-CD1 4.05Å; I786-L788 HydrophobicContact CG2-CD2 3.84Å; I786-V798 HydrophobicContact CG2-CB 4.39Å; I786-V798 HydrophobicContact CG2-CG1 3.84Å; I786-V798 HydrophobicContact CG2-CG2 4.21Å; I786-I805 HydrophobicContact CD1-CG1 4.49Å; I786-I805 HydrophobicContact CG1-CG1 3.99Å; I786-I805 HydrophobicContact CG1-CG2 3.89Å; I786-H809 HydrophobicContact CD1-CB 4Å
787	T	95.5	Very high	90.6	Very high	40 Å²	40	81.2 Å²	81.2	25%	0.245	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.4	167.3	-56.1	0	0	0	0	108.4	R799 A800 K1112	T787-R799 WeakPolarHBondContact O-CA 3.27Å; T787-R799 WeakPolarHBondContact O-CB 3.4Å; T787-R799 PolarHBondContact O-N 3.16Å; T787-A800 WeakPolarHBondContact CB-O 3.31Å; T787-A800 PolarHBondContact N-O 3.22Å; T787-A800 PolarHBondContact O-N 3.23Å; T787-K1112 PolarHBondContact OG1-NZ 3.05Å
788	L	94.5	Very high	90.7	Very high	77 Å²	77	80.2 Å²	80.2	40%	0.403	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	167.5	177.4	-60.8	175.8	0	0	0	112.3	M783 I786 D797	M783-L788 HydrophobicContact CE-CD1 4.29Å; M783-L788 HydrophobicContact CE-CD2 3.75Å; I786-L788 HydrophobicContact CG2-CD2 3.84Å; L788-D797 CarbonylContact C-O 3.23Å; L788-D797 WeakPolarHBondContact CA-O 3.45Å; L788-D797 WeakPolarHBondContact CB-O 3.46Å; L788-D797 VanDerWaalsContact CD2-O 3.26Å; L788-D797 WeakPolarHBondContact CD2-O 3.42Å
789	K	92.6	Very high	90.9	Very high	77 Å²	77	78.8 Å²	78.8	34%	0.335	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.7	154.8	168	79.6	-175.1	-170.7	-151.6	0	111.3	D793 G795 P796 D797	K789-D793 HydrophobicContact CB-CB 4.25Å; K789-G795 WeakPolarHBondContact CD-O 3.41Å; K789-G795 PolarHBondContact NZ-O 3.14Å; K789-P796 WeakPolarHBondContact CD-O 3.37Å; K789-D797 VanDerWaalsContact CE-OD1 3.24Å; K789-D797 WeakPolarHBondContact CE-OD1 3.39Å; K789-D797 PolarHBondContact N-O 3.23Å; K789-D797 IonicContact NZ-OD1 3.56Å; K789-D797 PolarHBondContact NZ-OD1 3.18Å
790	Q	88.8	Confident	91.1	Very high	130 Å²	130	75.2 Å²	75.2	61%	0.607	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-83.3	159.1	169.5	-56.4	-176.4	15.8	0	0	109.7	N792 D793	Q790-N792 PolarHBondContact O-N 3.43Å; Q790-D793 HydrophobicContact CB-CB 4.4Å; Q790-D793 WeakPolarHBondContact CB-OD2 3.5Å; Q790-D793 WeakPolarHBondContact CG-OD2 3.43Å; Q790-D793 PolarHBondContact N-OD2 3.07Å; Q790-D793 PolarHBondContact O-N 3.19Å
791	E	83.4	Confident	91.3	Very high	196 Å²	196	67.1 Å²	67.1	92%	0.916	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.9	-175.4	-61.3	-175.9	143.8	0	0	114.2
792	N	84.5	Confident	91.5	Very high	159 Å²	159	65.2 Å²	65.2	85%	0.85	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	4.1	178.9	-56.2	-75.4	0	0	0	113.6	Q790	Q790-N792 PolarHBondContact O-N 3.43Å
793	D	84.1	Confident	91.6	Very high	57 Å²	57	66 Å²	66	31%	0.305	35%	0.353	S	S	.	.			trans	-90.7	123	176.6	-79.4	-31.4	0	0	0	110.5	K789 Q790 R799	K789-D793 HydrophobicContact CB-CB 4.25Å; Q790-D793 HydrophobicContact CB-CB 4.4Å; Q790-D793 WeakPolarHBondContact CB-OD2 3.5Å; Q790-D793 WeakPolarHBondContact CG-OD2 3.43Å; Q790-D793 PolarHBondContact N-OD2 3.07Å; Q790-D793 PolarHBondContact O-N 3.19Å; D793-R799 IonicContact OD2-CZ 3.46Å; D793-R799 IonicContact OD2-NH1 3.99Å; D793-R799 PolarHBondContact OD2-NH1 3.4Å; D793-R799 IonicContact OD2-NH2 3.53Å
794	D	82.3	Confident	91.8	Very high	173 Å²	173	65.3 Å²	65.3	93%	0.925	35%	0.35	S	S	*	.			trans	-66.5	138	171.3	-90.3	-42.5	0	0	0	112.1
795	G	83.4	Confident	91.9	Very high	38 Å²	38	61.1 Å²	61.1	39%	0.392	32%	0.321	S	S	.	.	S	Bend	trans	125.9	-159	170.5	0	0	0	0	0	115.5	K789	K789-G795 WeakPolarHBondContact CD-O 3.41Å; K789-G795 PolarHBondContact NZ-O 3.14Å
796	P	88.6	Confident	92	Very high	11 Å²	11	58.4 Å²	58.4	7%	0.071	31%	0.31	C	S	.	.			trans	-69.6	150.9	-176.3	31.7	-37.4	0	0	0	111.8	K789 V798 W1119	K789-P796 WeakPolarHBondContact CD-O 3.37Å; P796-V798 VanDerWaalsContact C-N 3.26Å; P796-V798 WeakPolarHBondContact CG-O 3.47Å; P796-V798 PolarHBondContact O-N 3.15Å; P796-W1119 HydrophobicContact CB-CB 4.22Å; P796-W1119 HydrophobicContact CB-CD2 3.63Å; P796-W1119 HydrophobicContact CB-CE3 3.97Å; P796-W1119 HydrophobicContact CB-CG 3.75Å; P796-W1119 HydrophobicContact CB-CZ2 4.46Å; P796-W1119 HydrophobicContact CB-CZ3 4.5Å; P796-W1119 HydrophobicContact CG-CB 3.65Å; P796-W1119 HydrophobicContact CG-CD2 4.09Å; P796-W1119 HydrophobicContact CG-CG 3.65Å
797	D	91	Very high	92.1	Very high	101 Å²	101	58 Å²	58	54%	0.54	31%	0.308	S	S	.	.	S	Bend	trans	-62.2	-36.7	178.2	-54.5	-35.4	0	0	0	111.7	L788 K789 R799	L788-D797 CarbonylContact C-O 3.23Å; L788-D797 WeakPolarHBondContact CA-O 3.45Å; L788-D797 WeakPolarHBondContact CB-O 3.46Å; L788-D797 VanDerWaalsContact CD2-O 3.26Å; L788-D797 WeakPolarHBondContact CD2-O 3.42Å; K789-D797 VanDerWaalsContact CE-OD1 3.24Å; K789-D797 WeakPolarHBondContact CE-OD1 3.39Å; K789-D797 PolarHBondContact N-O 3.23Å; K789-D797 IonicContact NZ-OD1 3.56Å; K789-D797 PolarHBondContact NZ-OD1 3.18Å; D797-R799 PolarHBondContact O-N 2.87Å
798	V	94.3	Very high	92.1	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.055	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	108.2	171.1	179.2	0	0	0	0	109.9	I786 P796 L806 Y821 F1115	I786-V798 HydrophobicContact CG2-CB 4.39Å; I786-V798 HydrophobicContact CG2-CG1 3.84Å; I786-V798 HydrophobicContact CG2-CG2 4.21Å; P796-V798 VanDerWaalsContact C-N 3.26Å; P796-V798 WeakPolarHBondContact CG-O 3.47Å; P796-V798 PolarHBondContact O-N 3.15Å; V798-L806 HydrophobicContact CG1-CD2 3.68Å; V798-Y821 HydrophobicContact CB-CD2 4.31Å; V798-Y821 HydrophobicContact CB-CE2 3.95Å; V798-Y821 HydrophobicContact CG1-CE2 3.87Å; V798-Y821 HydrophobicContact CG2-CD2 4.1Å; V798-Y821 HydrophobicContact CG2-CE2 3.93Å; V798-F1115 HydrophobicContact CB-CD1 4.18Å; V798-F1115 HydrophobicContact CG1-CB 4.15Å; V798-F1115 HydrophobicContact CG1-CD1 4.03Å; V798-F1115 HydrophobicContact CG1-CG 4.14Å
799	R	95.3	Very high	92.1	Very high	67 Å²	67	52.8 Å²	52.8	25%	0.253	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-46.5	179.3	178.2	-175.6	-172	150.6	14	112.5	T787 D793 D797 I1109 F1115 S1116	T787-R799 WeakPolarHBondContact O-CA 3.27Å; T787-R799 WeakPolarHBondContact O-CB 3.4Å; T787-R799 PolarHBondContact O-N 3.16Å; D793-R799 IonicContact OD2-CZ 3.46Å; D793-R799 IonicContact OD2-NH1 3.99Å; D793-R799 PolarHBondContact OD2-NH1 3.4Å; D793-R799 IonicContact OD2-NH2 3.53Å; D797-R799 PolarHBondContact O-N 2.87Å; R799-I1109 HydrophobicContact CG-CD1 4.39Å; R799-F1115 WeakPolarHBondContact O-CA 3.28Å; R799-F1115 PolarHBondContact O-N 3Å; R799-S1116 WeakPolarHBondContact CA-OG 3.39Å; R799-S1116 PolarHBondContact O-N 3.29Å; R799-S1116 VanDerWaalsContact O-N 3.15Å
800	A	96.9	Very high	92.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	158.1	178	0	0	0	0	0	113.2	T787 I1109 K1112 V1113	T787-A800 WeakPolarHBondContact CB-O 3.31Å; T787-A800 PolarHBondContact N-O 3.22Å; T787-A800 PolarHBondContact O-N 3.23Å; A800-I1109 HydrophobicContact CB-CB 4.31Å; A800-K1112 HydrophobicContact CB-CB 4.01Å; A800-V1113 WeakPolarHBondContact CA-O 3.42Å; A800-V1113 VanDerWaalsContact CB-O 3.24Å; A800-V1113 WeakPolarHBondContact CB-O 3.14Å
801	G	96.9	Very high	92.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	166.1	176.6	0	0	0	0	0	112	K1112 V1113	G801-K1112 CarbonylContact O-C 3.44Å; G801-K1112 WeakPolarHBondContact O-CB 3.47Å; G801-V1113 PolarHBondContact N-O 3.01Å; G801-V1113 WeakPolarHBondContact O-CB 3.5Å; G801-V1113 PolarHBondContact O-N 2.96Å
802	S	96.9	Very high	92.8	Very high	31 Å²	31	34.8 Å²	34.8	22%	0.217	20%	0.197	C	C	.	.			trans	-61.4	158.8	162.6	60.8	0	0	0	0	110.1	E773 D804 I805 L806	E773-S802 VanDerWaalsContact OE2-CB 3.31Å; E773-S802 WeakPolarHBondContact OE2-CB 3.44Å; E773-S802 PolarHBondContact OE2-OG 3.28Å; S802-D804 PolarHBondContact O-N 3.5Å; S802-I805 PolarHBondContact O-N 3.35Å; S802-I805 VanDerWaalsContact OG-CB 3.28Å; S802-I805 WeakPolarHBondContact OG-CB 3.37Å; S802-I805 VanDerWaalsContact OG-CG2 3.28Å; S802-I805 WeakPolarHBondContact OG-CG2 3.45Å; S802-I805 PolarHBondContact OG-N 3.37Å; S802-L806 WeakPolarHBondContact O-CB 3.43Å; S802-L806 WeakPolarHBondContact O-CD1 3.49Å; S802-L806 WeakPolarHBondContact O-CG 3.48Å; S802-L806 PolarHBondContact O-N 3.02Å; S802-L806 VanDerWaalsContact O-N 3.15Å
803	G	96.3	Very high	92.3	Very high	17 Å²	17	28.3 Å²	28.3	18%	0.175	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-32.6	175.1	0	0	0	0	0	112.5	L807	G803-L807 WeakPolarHBondContact O-CB 3.44Å; G803-L807 PolarHBondContact O-N 3.05Å
804	D	97.1	Very high	91.5	Very high	34 Å²	34	31.7 Å²	31.7	18%	0.182	18%	0.177	C	C	.	.	H	α-helix	trans	-74.9	-46.9	179.5	-62.6	-79.6	0	0	0	112.6	E773 L774 S802 L806 L807 V808 K841	E773-D804 HydrophobicContact CB-CB 3.93Å; L774-D804 WeakPolarHBondContact CD1-OD1 3.47Å; L774-D804 HydrophobicContact CD2-CB 3.97Å; L774-D804 WeakPolarHBondContact CD2-OD1 3.3Å; L774-D804 HydrophobicContact CG-CB 4.23Å; L774-D804 WeakPolarHBondContact CG-OD1 3.42Å; S802-D804 PolarHBondContact O-N 3.5Å; D804-L806 VanDerWaalsContact C-N 3.28Å; D804-L806 PolarHBondContact O-N 2.99Å; D804-L807 WeakPolarHBondContact O-CB 3.48Å; D804-L807 PolarHBondContact O-N 2.9Å; D804-V808 WeakPolarHBondContact O-CB 3.29Å; D804-V808 WeakPolarHBondContact O-CG2 3.44Å; D804-V808 PolarHBondContact O-N 3.08Å; D804-K841 WeakPolarHBondContact OD1-CD 3.46Å; D804-K841 WeakPolarHBondContact OD1-CE 3.43Å; D804-K841 IonicContact OD1-NZ 3.29Å; D804-K841 PolarHBondContact OD1-NZ 2.8Å; D804-K841 IonicContact OD2-NZ 3.45Å; D804-K841 PolarHBondContact OD2-NZ 3.26Å
805	I	96.9	Very high	91	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.6	-32.3	178.8	-152.4	70	0	0	0	112.2	L776 I782 R785 I786 S802 V808 H809	L776-I805 HydrophobicContact CD1-CD1 3.78Å; I782-I805 HydrophobicContact CB-CD1 4.47Å; I782-I805 HydrophobicContact CG2-CD1 4.12Å; I782-I805 HydrophobicContact CG2-CG1 4.18Å; R785-I805 HydrophobicContact CB-CD1 4.02Å; R785-I805 HydrophobicContact CB-CG1 3.91Å; I786-I805 HydrophobicContact CD1-CG1 4.49Å; I786-I805 HydrophobicContact CG1-CG1 3.99Å; I786-I805 HydrophobicContact CG1-CG2 3.89Å; S802-I805 PolarHBondContact O-N 3.35Å; S802-I805 VanDerWaalsContact OG-CB 3.28Å; S802-I805 WeakPolarHBondContact OG-CB 3.37Å; S802-I805 VanDerWaalsContact OG-CG2 3.28Å; S802-I805 WeakPolarHBondContact OG-CG2 3.45Å; S802-I805 PolarHBondContact OG-N 3.37Å; I805-V808 HydrophobicContact CD1-CB 4.44Å; I805-V808 HydrophobicContact CD1-CG1 4.31Å; I805-V808 PolarHBondContact O-N 3.08Å; I805-H809 WeakPolarHBondContact O-CB 3.49Å; I805-H809 PolarHBondContact O-N 3.38Å
806	L	97.1	Very high	90.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.6	-35.3	175.9	-66.4	171.5	0	0	0	111.9	V798 S802 D804 A810 Y821 F825 V1113 F1115	V798-L806 HydrophobicContact CG1-CD2 3.68Å; S802-L806 WeakPolarHBondContact O-CB 3.43Å; S802-L806 WeakPolarHBondContact O-CD1 3.49Å; S802-L806 WeakPolarHBondContact O-CG 3.48Å; S802-L806 PolarHBondContact O-N 3.02Å; S802-L806 VanDerWaalsContact O-N 3.15Å; D804-L806 VanDerWaalsContact C-N 3.28Å; D804-L806 PolarHBondContact O-N 2.99Å; L806-A810 WeakPolarHBondContact O-CB 3.36Å; L806-A810 PolarHBondContact O-N 2.97Å; L806-Y821 VanDerWaalsContact CA-OH 3.3Å; L806-Y821 WeakPolarHBondContact CA-OH 3.16Å; L806-Y821 WeakPolarHBondContact CB-OH 3.4Å; L806-Y821 WeakPolarHBondContact CD2-OH 3.5Å; L806-Y821 PolarHBondContact O-OH 3.13Å; L806-F825 HydrophobicContact CB-CD2 4.29Å; L806-F825 HydrophobicContact CB-CE2 4.01Å; L806-V1113 HydrophobicContact CD1-CB 3.78Å; L806-V1113 HydrophobicContact CD1-CG1 4.03Å; L806-V1113 HydrophobicContact CD1-CG2 4.47Å; L806-F1115 HydrophobicContact CD1-CD2 4.21Å; L806-F1115 HydrophobicContact CD2-CB 4.4Å; L806-F1115 HydrophobicContact CD2-CD2 4.14Å; L806-F1115 HydrophobicContact CD2-CG 4.35Å
807	L	97.1	Very high	89.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-42.6	171.9	178.4	171.3	0	0	0	111.4	L774 G803 D804 H809 A810 T811 F825 L838 K841 L842	L774-L807 HydrophobicContact CD2-CD1 4.15Å; L774-L807 HydrophobicContact CD2-CD2 3.89Å; G803-L807 WeakPolarHBondContact O-CB 3.44Å; G803-L807 PolarHBondContact O-N 3.05Å; D804-L807 WeakPolarHBondContact O-CB 3.48Å; D804-L807 PolarHBondContact O-N 2.9Å; L807-H809 VanDerWaalsContact C-N 3.34Å; L807-H809 PolarHBondContact O-N 2.67Å; L807-A810 CarbonylContact O-C 3.48Å; L807-A810 PolarHBondContact O-N 3.11Å; L807-T811 HydrophobicContact CD2-CG2 4.4Å; L807-T811 WeakPolarHBondContact O-CG2 3.48Å; L807-T811 PolarHBondContact O-N 3Å; L807-T811 PolarHBondContact O-OG1 3.23Å; L807-F825 HydrophobicContact CB-CE2 4.32Å; L807-F825 HydrophobicContact CB-CZ 3.94Å; L807-F825 HydrophobicContact CG-CZ 4.49Å; L807-L838 HydrophobicContact CD1-CD1 3.59Å; L807-L838 HydrophobicContact CG-CD1 4.08Å; L807-K841 HydrophobicContact CD1-CB 3.55Å; L807-K841 HydrophobicContact CD1-CD 4.42Å; L807-L842 HydrophobicContact CD1-CD2 4.34Å; L807-L842 HydrophobicContact CD1-CG 4.28Å; L807-L842 HydrophobicContact CD2-CD2 3.77Å; L807-L842 HydrophobicContact CG-CD2 3.94Å; L807-L842 HydrophobicContact CG-CG 4.39Å
808	V	96.3	Very high	89.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-44.9	175.3	166.3	0	0	0	0	110.5	E773 L774 L776 I782 D804 I805 T811 E812	E773-V808 WeakPolarHBondContact O-CG2 3.45Å; L774-V808 HydrophobicContact CD2-CG2 4.21Å; L776-V808 HydrophobicContact CB-CG1 4.27Å; I782-V808 HydrophobicContact CD1-CG1 3.57Å; I782-V808 HydrophobicContact CG1-CG1 3.63Å; I782-V808 HydrophobicContact CG2-CG1 4.05Å; D804-V808 WeakPolarHBondContact O-CB 3.29Å; D804-V808 WeakPolarHBondContact O-CG2 3.44Å; D804-V808 PolarHBondContact O-N 3.08Å; I805-V808 HydrophobicContact CD1-CB 4.44Å; I805-V808 HydrophobicContact CD1-CG1 4.31Å; I805-V808 PolarHBondContact O-N 3.08Å; V808-T811 WeakPolarHBondContact CA-OG1 3.49Å; V808-T811 CarbonylContact O-C 3.57Å; V808-T811 PolarHBondContact O-N 3.3Å; V808-T811 PolarHBondContact O-OG1 3.33Å; V808-E812 PolarHBondContact O-N 3.32Å; V808-E812 VanDerWaalsContact O-N 3.1Å
809	H	95.3	Very high	88.9	Confident	7 Å²	7	33 Å²	33	3%	0.032	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-47.9	172.6	-159.1	64.1	0	0	0	111.2	I782 M783 I786 I805 L807 T811 E812 R815 L818 Y821	I782-H809 HydrophobicContact CG2-CB 4.47Å; M783-H809 PolarHBondContact SD-CE1 3.11Å; I786-H809 HydrophobicContact CD1-CB 4Å; I805-H809 WeakPolarHBondContact O-CB 3.49Å; I805-H809 PolarHBondContact O-N 3.38Å; L807-H809 VanDerWaalsContact C-N 3.34Å; L807-H809 PolarHBondContact O-N 2.67Å; H809-T811 PolarHBondContact O-N 3.11Å; H809-E812 IonicContact CE1-OE1 3.43Å; H809-E812 PolarHBondContact CE1-OE1 3.05Å; H809-E812 IonicContact CG-OE1 2.88Å; H809-E812 IonicContact ND1-OE1 3.55Å; H809-E812 PolarHBondContact ND1-OE1 2.86Å; H809-E812 IonicContact ND1-OE2 2.73Å; H809-E812 WeakPolarHBondContact O-CB 3.4Å; H809-E812 PolarHBondContact O-N 3.35Å; H809-R815 PolarHBondContact CE1-NH2 3.14Å; H809-L818 WeakPolarHBondContact O-CD2 3.14Å; H809-Y821 HydrophobicContact CB-CE1 4.02Å; H809-Y821 AromaticContact CD2-CD1 3.69Å; H809-Y821 AromaticContact CD2-CE1 3.56Å; H809-Y821 AromaticContact CD2-CE2 3.91Å; H809-Y821 AromaticContact CD2-CG 3.95Å; H809-Y821 AromaticContact CD2-CZ 3.68Å
810	A	94.6	Very high	88.7	Confident	5 Å²	5	34.1 Å²	34.1	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-59.8	-14.8	176.4	0	0	0	0	0	114.1	L806 L807 Y821 F825	L806-A810 WeakPolarHBondContact O-CB 3.36Å; L806-A810 PolarHBondContact O-N 2.97Å; L807-A810 CarbonylContact O-C 3.48Å; L807-A810 PolarHBondContact O-N 3.11Å; A810-Y821 HydrophobicContact CB-CD1 4.44Å; A810-Y821 HydrophobicContact CB-CE1 3.9Å; A810-F825 HydrophobicContact CB-CB 4.31Å; A810-F825 HydrophobicContact CB-CD1 3.89Å; A810-F825 HydrophobicContact CB-CD2 4.15Å; A810-F825 HydrophobicContact CB-CE1 4.24Å; A810-F825 HydrophobicContact CB-CE2 4.48Å; A810-F825 HydrophobicContact CB-CG 3.86Å
811	T	94.1	Very high	88.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	6	178	55.2	0	0	0	0	113.9	L807 V808 H809 L842 R845 N863 T864 V867	L807-T811 HydrophobicContact CD2-CG2 4.4Å; L807-T811 WeakPolarHBondContact O-CG2 3.48Å; L807-T811 PolarHBondContact O-N 3Å; L807-T811 PolarHBondContact O-OG1 3.23Å; V808-T811 WeakPolarHBondContact CA-OG1 3.49Å; V808-T811 CarbonylContact O-C 3.57Å; V808-T811 PolarHBondContact O-N 3.3Å; V808-T811 PolarHBondContact O-OG1 3.33Å; H809-T811 PolarHBondContact O-N 3.11Å; T811-L842 HydrophobicContact CG2-CD2 3.74Å; T811-R845 PolarHBondContact OG1-NE 3.35Å; T811-N863 VanDerWaalsContact C-ND2 3.29Å; T811-N863 PolarHBondContact O-ND2 3.38Å; T811-T864 HydrophobicContact CG2-CG2 4.25Å; T811-V867 HydrophobicContact CG2-CB 4.04Å; T811-V867 HydrophobicContact CG2-CG1 4.18Å; T811-V867 HydrophobicContact CG2-CG2 3.98Å
812	E	90.6	Very high	88.4	Confident	21 Å²	21	35.6 Å²	35.6	10%	0.098	18%	0.182	C	C	.	.			trans	-58.2	147.9	169.5	-85	-179.4	-142.8	0	0	111.8	H779 I782 V808 H809 R815 L818 N863	H779-E812 IonicContact CE1-OE2 2.73Å; H779-E812 IonicContact CG-OE2 3.2Å; H779-E812 IonicContact ND1-OE1 3.73Å; H779-E812 PolarHBondContact ND1-OE1 2.96Å; H779-E812 IonicContact ND1-OE2 3.37Å; H779-E812 PolarHBondContact ND1-OE2 3.05Å; I782-E812 HydrophobicContact CD1-CG 4.17Å; I782-E812 WeakPolarHBondContact CG2-OE1 3.39Å; V808-E812 PolarHBondContact O-N 3.32Å; V808-E812 VanDerWaalsContact O-N 3.1Å; H809-E812 IonicContact CE1-OE1 3.43Å; H809-E812 PolarHBondContact CE1-OE1 3.05Å; H809-E812 IonicContact CG-OE1 2.88Å; H809-E812 IonicContact ND1-OE1 3.55Å; H809-E812 PolarHBondContact ND1-OE1 2.86Å; H809-E812 IonicContact ND1-OE2 2.73Å; H809-E812 WeakPolarHBondContact O-CB 3.4Å; H809-E812 PolarHBondContact O-N 3.35Å; E812-R815 IonicContact OE2-CZ 3.59Å; E812-R815 IonicContact OE2-NE 3.59Å; E812-R815 PolarHBondContact OE2-NE 2.78Å; E812-R815 IonicContact OE2-NH2 2.69Å; E812-L818 HydrophobicContact CB-CD1 4.28Å; E812-L818 HydrophobicContact CB-CD2 3.93Å; E812-N863 PolarHBondContact O-ND2 3.34Å
813	T	73.6	Confident	88.2	Confident	22 Å²	22	35.7 Å²	35.7	14%	0.135	18%	0.179	C	C	.	.			trans	-105.7	155	176.5	53	0	0	0	0	111.6	R815 R859 V860 N863	T813-R815 PolarHBondContact O-N 3.17Å; T813-R859 HydrophobicContact CG2-CG 4.09Å; T813-V860 HydrophobicContact CG2-CG2 4.22Å; T813-N863 HydrophobicContact CG2-CB 3.55Å
814	E	67.8	Low	88.1	Confident	129 Å²	129	34.9 Å²	34.9	60%	0.603	17%	0.171	S	C	*	.	S	Bend	trans	84.7	-16.3	164.3	-59.6	165.4	-129.4	0	0	119.1	R859	E814-R859 VanDerWaalsContact OE1-CD 3.29Å; E814-R859 WeakPolarHBondContact OE1-CD 3.49Å; E814-R859 IonicContact OE1-CZ 2.73Å; E814-R859 IonicContact OE1-NE 3.7Å; E814-R859 IonicContact OE1-NH1 3.85Å; E814-R859 PolarHBondContact OE1-NH1 3.22Å; E814-R859 IonicContact OE2-NH1 2.71Å; E814-R859 PolarHBondContact OE2-NH1 3.19Å; E814-R859 VanDerWaalsContact OE2-NH1 3.16Å
815	R	71.1	Confident	88	Confident	69 Å²	69	33.3 Å²	33.3	26%	0.26	16%	0.162	S	C	.	.			trans	-99.1	130.8	175	-13.5	-177.2	-75.8	97.4	1.5	111.2	H779 H809 E812 T813 D817 L818	H779-R815 PolarHBondContact CE1-NE 3.29Å; H779-R815 PolarHBondContact ND1-NE 3.03Å; H809-R815 PolarHBondContact CE1-NH2 3.14Å; E812-R815 IonicContact OE2-CZ 3.59Å; E812-R815 IonicContact OE2-NE 3.59Å; E812-R815 PolarHBondContact OE2-NE 2.78Å; E812-R815 IonicContact OE2-NH2 2.69Å; T813-R815 PolarHBondContact O-N 3.17Å; R815-D817 VanDerWaalsContact CB-OD1 3.22Å; R815-D817 WeakPolarHBondContact CB-OD1 2.95Å; R815-D817 IonicContact CZ-OD2 2.88Å; R815-D817 VanDerWaalsContact NH1-CG 3.32Å; R815-D817 IonicContact NH1-OD1 3.53Å; R815-D817 PolarHBondContact NH1-OD1 3.07Å; R815-D817 IonicContact NH1-OD2 2.73Å; R815-D817 PolarHBondContact NH1-OD2 3.13Å; R815-D817 IonicContact NH2-OD2 3.99Å; R815-L818 HydrophobicContact CB-CD1 3.6Å; R815-L818 HydrophobicContact CG-CD1 3.85Å; R815-L818 WeakPolarHBondContact O-CD1 3.42Å
816	K	68.4	Low	88	Confident	142 Å²	142	33.3 Å²	33.3	62%	0.617	16%	0.162	S	C	*	.	S	Bend	trans	-80.9	-22.8	-171.1	-69.7	-176	178.8	-179.4	0	113.8	T18 L818 V819	T18-K816 HydrophobicContact CG2-CD 4.47Å; K816-L818 VanDerWaalsContact C-N 3.3Å; K816-L818 PolarHBondContact O-N 2.99Å; K816-V819 VanDerWaalsContact O-CG2 3.29Å; K816-V819 WeakPolarHBondContact O-CG2 3.24Å; K816-V819 PolarHBondContact O-N 3.32Å
817	D	72.1	Confident	87.8	Confident	103 Å²	103	33.5 Å²	33.5	55%	0.551	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.3	-179.9	54.6	-59.1	0	0	0	112.7	R815 V819	R815-D817 VanDerWaalsContact CB-OD1 3.22Å; R815-D817 WeakPolarHBondContact CB-OD1 2.95Å; R815-D817 IonicContact CZ-OD2 2.88Å; R815-D817 VanDerWaalsContact NH1-CG 3.32Å; R815-D817 IonicContact NH1-OD1 3.53Å; R815-D817 PolarHBondContact NH1-OD1 3.07Å; R815-D817 IonicContact NH1-OD2 2.73Å; R815-D817 PolarHBondContact NH1-OD2 3.13Å; R815-D817 IonicContact NH2-OD2 3.99Å; D817-V819 PolarHBondContact O-N 2.98Å; D817-V819 VanDerWaalsContact O-N 3.14Å
818	L	84.6	Confident	87.7	Confident	13 Å²	13	33.5 Å²	33.5	7%	0.068	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-13.2	172.2	-67.6	114.8	0	0	0	114.2	H809 E812 R815 K816 L820 Y821 C822	H809-L818 WeakPolarHBondContact O-CD2 3.14Å; E812-L818 HydrophobicContact CB-CD1 4.28Å; E812-L818 HydrophobicContact CB-CD2 3.93Å; R815-L818 HydrophobicContact CB-CD1 3.6Å; R815-L818 HydrophobicContact CG-CD1 3.85Å; R815-L818 WeakPolarHBondContact O-CD1 3.42Å; K816-L818 VanDerWaalsContact C-N 3.3Å; K816-L818 PolarHBondContact O-N 2.99Å; L818-L820 VanDerWaalsContact C-N 3.27Å; L818-L820 PolarHBondContact O-N 3.24Å; L818-Y821 CarbonylContact O-C 3.59Å; L818-Y821 WeakPolarHBondContact O-CB 3.46Å; L818-Y821 PolarHBondContact O-N 3.14Å; L818-Y821 VanDerWaalsContact O-N 3.11Å; L818-C822 WeakPolarHBondContact O-CB 3.46Å; L818-C822 PolarHBondContact O-N 3.39Å
819	V	88.4	Confident	87.7	Confident	33 Å²	33	33.5 Å²	33.5	20%	0.2	16%	0.164	C	C	.	.	H	α-helix	trans	-57.1	-45.6	-177.5	174.9	0	0	0	0	110.4	T20 K816 D817 C822 E823	T20-V819 HydrophobicContact CG2-CG2 3.66Å; T20-V819 VanDerWaalsContact OG1-CG2 3.24Å; T20-V819 WeakPolarHBondContact OG1-CG2 3.48Å; K816-V819 VanDerWaalsContact O-CG2 3.29Å; K816-V819 WeakPolarHBondContact O-CG2 3.24Å; K816-V819 PolarHBondContact O-N 3.32Å; D817-V819 PolarHBondContact O-N 2.98Å; D817-V819 VanDerWaalsContact O-N 3.14Å; V819-C822 PolarHBondContact O-N 2.86Å; V819-E823 WeakPolarHBondContact O-CG 3.49Å; V819-E823 PolarHBondContact O-N 2.97Å
820	L	89.9	Confident	87.6	Confident	89 Å²	89	34.7 Å²	34.7	47%	0.466	17%	0.168	S	C	.	.	H	α-helix	trans	-71.4	-32.5	178.3	-163.9	65	0	0	0	112.5	L818 A824 W1119 F1122	L818-L820 VanDerWaalsContact C-N 3.27Å; L818-L820 PolarHBondContact O-N 3.24Å; L820-A824 WeakPolarHBondContact O-CB 3.13Å; L820-A824 PolarHBondContact O-N 3.42Å; L820-W1119 HydrophobicContact CB-CH2 4.18Å; L820-W1119 HydrophobicContact CD2-CH2 3.67Å; L820-W1119 HydrophobicContact CD2-CZ2 3.77Å; L820-W1119 HydrophobicContact CG-CH2 3.66Å; L820-W1119 HydrophobicContact CG-CZ2 4.2Å; L820-W1119 HydrophobicContact CG-CZ3 4.43Å; L820-F1122 HydrophobicContact CD1-CE1 3.71Å; L820-F1122 HydrophobicContact CD1-CZ 3.76Å; L820-F1122 HydrophobicContact CG-CE1 4.15Å
821	Y	93.8	Very high	87.6	Confident	13 Å²	13	36 Å²	36	5%	0.051	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-42.5	172	177.2	-87.8	0	0	0	112.3	V798 L806 H809 A810 L818 A824 F825 F1115	V798-Y821 HydrophobicContact CB-CD2 4.31Å; V798-Y821 HydrophobicContact CB-CE2 3.95Å; V798-Y821 HydrophobicContact CG1-CE2 3.87Å; V798-Y821 HydrophobicContact CG2-CD2 4.1Å; V798-Y821 HydrophobicContact CG2-CE2 3.93Å; L806-Y821 VanDerWaalsContact CA-OH 3.3Å; L806-Y821 WeakPolarHBondContact CA-OH 3.16Å; L806-Y821 WeakPolarHBondContact CB-OH 3.4Å; L806-Y821 WeakPolarHBondContact CD2-OH 3.5Å; L806-Y821 PolarHBondContact O-OH 3.13Å; H809-Y821 HydrophobicContact CB-CE1 4.02Å; H809-Y821 AromaticContact CD2-CD1 3.69Å; H809-Y821 AromaticContact CD2-CE1 3.56Å; H809-Y821 AromaticContact CD2-CE2 3.91Å; H809-Y821 AromaticContact CD2-CG 3.95Å; H809-Y821 AromaticContact CD2-CZ 3.68Å; A810-Y821 HydrophobicContact CB-CD1 4.44Å; A810-Y821 HydrophobicContact CB-CE1 3.9Å; L818-Y821 CarbonylContact O-C 3.59Å; L818-Y821 WeakPolarHBondContact O-CB 3.46Å; L818-Y821 PolarHBondContact O-N 3.14Å; L818-Y821 VanDerWaalsContact O-N 3.11Å; Y821-A824 PolarHBondContact O-N 3.4Å; Y821-F825 HydrophobicContact CE1-CB 4.35Å; Y821-F825 VanDerWaalsContact O-CB 3.31Å; Y821-F825 WeakPolarHBondContact O-CB 3.48Å; Y821-F825 PolarHBondContact O-N 3.02Å; Y821-F1115 HydrophobicContact CD2-CD1 4.34Å; Y821-F1115 AromaticContact CD2-CE1 3.49Å; Y821-F1115 HydrophobicContact CD2-CE1 3.49Å; Y821-F1115 VanDerWaalsContact CD2-CE1 3.49Å; Y821-F1115 AromaticContact CD2-CZ 3.65Å; Y821-F1115 HydrophobicContact CD2-CZ 3.65Å; Y821-F1115 AromaticContact CE2-CD1 3.85Å; Y821-F1115 HydrophobicContact CE2-CD1 3.85Å; Y821-F1115 HydrophobicContact CE2-CD2 4.31Å; Y821-F1115 AromaticContact CE2-CE1 3.28Å; Y821-F1115 HydrophobicContact CE2-CE1 3.28Å; Y821-F1115 AromaticContact CE2-CE2 3.81Å; Y821-F1115 HydrophobicContact CE2-CE2 3.81Å; Y821-F1115 HydrophobicContact CE2-CG 4.33Å; Y821-F1115 AromaticContact CE2-CZ 3.26Å; Y821-F1115 HydrophobicContact CE2-CZ 3.26Å; Y821-F1115 HydrophobicContact CG-CZ 4.49Å; Y821-F1115 AromaticContact CZ-CZ 3.84Å
822	C	94	Very high	87.6	Confident	18 Å²	18	38.3 Å²	38.3	12%	0.122	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-41.9	177.8	-165.4	0	0	0	0	110.8	L818 V819 F825 L826	L818-C822 WeakPolarHBondContact O-CB 3.46Å; L818-C822 PolarHBondContact O-N 3.39Å; V819-C822 PolarHBondContact O-N 2.86Å; C822-F825 PolarHBondContact O-N 3.39Å; C822-L826 WeakPolarHBondContact O-CB 3.38Å; C822-L826 VanDerWaalsContact O-CG 3.31Å; C822-L826 WeakPolarHBondContact O-CG 3.36Å; C822-L826 PolarHBondContact O-N 3.37Å
823	E	92.8	Very high	87.8	Confident	34 Å²	34	38.4 Å²	38.4	16%	0.159	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-48.1	170.5	-69.4	-60.1	120.2	0	0	112	V819 L826 T827 R870 F1122 R1129	V819-E823 WeakPolarHBondContact O-CG 3.49Å; V819-E823 PolarHBondContact O-N 2.97Å; E823-L826 PolarHBondContact O-N 3.46Å; E823-T827 VanDerWaalsContact O-CB 3.22Å; E823-T827 WeakPolarHBondContact O-CB 3.36Å; E823-T827 PolarHBondContact O-N 3.05Å; E823-T827 PolarHBondContact O-OG1 2.98Å; E823-R870 IonicContact OE1-CZ 2.65Å; E823-R870 IonicContact OE1-NH1 2.75Å; E823-R870 PolarHBondContact OE1-NH1 3.48Å; E823-R870 IonicContact OE1-NH2 3.98Å; E823-R870 PolarHBondContact OE1-NH2 2.97Å; E823-R870 IonicContact OE2-NH2 3.92Å; E823-F1122 HydrophobicContact CB-CE2 3.86Å; E823-F1122 HydrophobicContact CB-CZ 3.9Å; E823-R1129 IonicContact OE2-CZ 3.26Å; E823-R1129 IonicContact OE2-NH1 3.68Å; E823-R1129 PolarHBondContact OE2-NH1 3.19Å; E823-R1129 IonicContact OE2-NH2 2.72Å; E823-R1129 PolarHBondContact OE2-NH2 3.21Å
824	A	94.6	Very high	88.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-42.1	179.2	0	0	0	0	0	112.4	L820 Y821 T828 F1115 W1119 F1122	L820-A824 WeakPolarHBondContact O-CB 3.13Å; L820-A824 PolarHBondContact O-N 3.42Å; Y821-A824 PolarHBondContact O-N 3.4Å; A824-T828 WeakPolarHBondContact O-CB 2.75Å; A824-T828 WeakPolarHBondContact O-CG2 3.39Å; A824-T828 PolarHBondContact O-N 3.35Å; A824-T828 VanDerWaalsContact O-N 3.14Å; A824-T828 PolarHBondContact O-OG1 3.4Å; A824-F1115 HydrophobicContact CB-CE1 4.47Å; A824-F1115 HydrophobicContact CB-CZ 4.09Å; A824-W1119 HydrophobicContact CB-CE3 3.58Å; A824-W1119 HydrophobicContact CB-CZ3 3.72Å; A824-F1122 HydrophobicContact CB-CB 4.05Å; A824-F1122 HydrophobicContact CB-CD1 3.79Å; A824-F1122 HydrophobicContact CB-CD2 4.11Å; A824-F1122 HydrophobicContact CB-CE1 4.28Å; A824-F1122 HydrophobicContact CB-CG 3.69Å
825	F	96.1	Very high	90.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-53.7	175	179.8	-83.9	0	0	0	111.3	L806 L807 A810 Y821 C822 T827 T828 Y829 F832 L838 F1115	L806-F825 HydrophobicContact CB-CD2 4.29Å; L806-F825 HydrophobicContact CB-CE2 4.01Å; L807-F825 HydrophobicContact CB-CE2 4.32Å; L807-F825 HydrophobicContact CB-CZ 3.94Å; L807-F825 HydrophobicContact CG-CZ 4.49Å; A810-F825 HydrophobicContact CB-CB 4.31Å; A810-F825 HydrophobicContact CB-CD1 3.89Å; A810-F825 HydrophobicContact CB-CD2 4.15Å; A810-F825 HydrophobicContact CB-CE1 4.24Å; A810-F825 HydrophobicContact CB-CE2 4.48Å; A810-F825 HydrophobicContact CB-CG 3.86Å; Y821-F825 HydrophobicContact CE1-CB 4.35Å; Y821-F825 VanDerWaalsContact O-CB 3.31Å; Y821-F825 WeakPolarHBondContact O-CB 3.48Å; Y821-F825 PolarHBondContact O-N 3.02Å; C822-F825 PolarHBondContact O-N 3.39Å; F825-T827 VanDerWaalsContact C-N 3.32Å; F825-T827 PolarHBondContact O-N 2.96Å; F825-T828 PolarHBondContact O-N 3.14Å; F825-T828 VanDerWaalsContact O-N 3.14Å; F825-Y829 WeakPolarHBondContact O-CB 3.45Å; F825-Y829 PolarHBondContact O-N 2.94Å; F825-F832 HydrophobicContact CD2-CZ 4.07Å; F825-F832 HydrophobicContact CE2-CE2 4.25Å; F825-F832 AromaticContact CE2-CZ 3.76Å; F825-F832 HydrophobicContact CE2-CZ 3.76Å; F825-F832 HydrophobicContact CZ-CZ 4.48Å; F825-L838 HydrophobicContact CE1-CD1 4.05Å; F825-L838 HydrophobicContact CE1-CD2 4.14Å; F825-L838 HydrophobicContact CZ-CD1 4Å; F825-F1115 HydrophobicContact CB-CE2 4.39Å; F825-F1115 HydrophobicContact CB-CZ 4.48Å; F825-F1115 HydrophobicContact CD2-CE2 4.45Å
826	L	94.9	Very high	91.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-37.6	-178.7	-72.6	172.7	0	0	0	112.4	C822 E823 T828 Y829 V867 R870 V871	C822-L826 WeakPolarHBondContact O-CB 3.38Å; C822-L826 VanDerWaalsContact O-CG 3.31Å; C822-L826 WeakPolarHBondContact O-CG 3.36Å; C822-L826 PolarHBondContact O-N 3.37Å; E823-L826 PolarHBondContact O-N 3.46Å; L826-T828 VanDerWaalsContact C-N 3.33Å; L826-T828 PolarHBondContact O-N 2.68Å; L826-Y829 WeakPolarHBondContact O-CD1 3.27Å; L826-Y829 WeakPolarHBondContact O-CE1 3.44Å; L826-V867 HydrophobicContact CD2-CG1 4.22Å; L826-R870 HydrophobicContact CD1-CB 4.05Å; L826-R870 VanDerWaalsContact CD1-CZ 3.42Å; L826-V871 HydrophobicContact CD2-CG2 3.5Å; L826-V871 VanDerWaalsContact CD2-CG2 3.5Å
827	T	94.3	Very high	92.6	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-40.3	174.6	-58.9	0	0	0	0	111.7	E823 F825 I967 L971 F1122 L1125	E823-T827 VanDerWaalsContact O-CB 3.22Å; E823-T827 WeakPolarHBondContact O-CB 3.36Å; E823-T827 PolarHBondContact O-N 3.05Å; E823-T827 PolarHBondContact O-OG1 2.98Å; F825-T827 VanDerWaalsContact C-N 3.32Å; F825-T827 PolarHBondContact O-N 2.96Å; T827-I967 HydrophobicContact CG2-CG2 3.86Å; T827-L971 WeakPolarHBondContact O-CD1 3.35Å; T827-F1122 HydrophobicContact CG2-CD2 4.09Å; T827-L1125 HydrophobicContact CG2-CD1 4.16Å
828	T	95.5	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-118	-4.5	-162.3	65.9	0	0	0	0	116.5	A824 F825 L826 R830 T831 L971 R1118 Q1121 F1122	A824-T828 WeakPolarHBondContact O-CB 2.75Å; A824-T828 WeakPolarHBondContact O-CG2 3.39Å; A824-T828 PolarHBondContact O-N 3.35Å; A824-T828 VanDerWaalsContact O-N 3.14Å; A824-T828 PolarHBondContact O-OG1 3.4Å; F825-T828 PolarHBondContact O-N 3.14Å; F825-T828 VanDerWaalsContact O-N 3.14Å; L826-T828 VanDerWaalsContact C-N 3.33Å; L826-T828 PolarHBondContact O-N 2.68Å; T828-R830 PolarHBondContact O-N 2.78Å; T828-T831 WeakPolarHBondContact O-CB 3.43Å; T828-T831 WeakPolarHBondContact O-CG2 3.18Å; T828-T831 PolarHBondContact O-N 2.57Å; T828-T831 PolarHBondContact O-OG1 2.95Å; T828-L971 HydrophobicContact CG2-CD1 4.48Å; T828-R1118 HydrophobicContact CG2-CB 4.4Å; T828-R1118 WeakPolarHBondContact OG1-CB 3.36Å; T828-R1118 WeakPolarHBondContact OG1-CG 3.43Å; T828-Q1121 HydrophobicContact CG2-CB 4.29Å; T828-F1122 HydrophobicContact CG2-CB 4.17Å
829	Y	95.8	Very high	94.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-52.2	-33.6	-174.1	73	-98.5	0	0	0	113.7	F825 L826 T831 F832 I833 P835 L838	F825-Y829 WeakPolarHBondContact O-CB 3.45Å; F825-Y829 PolarHBondContact O-N 2.94Å; L826-Y829 WeakPolarHBondContact O-CD1 3.27Å; L826-Y829 WeakPolarHBondContact O-CE1 3.44Å; Y829-T831 PolarHBondContact O-N 2.94Å; Y829-F832 PolarHBondContact O-N 3.45Å; Y829-I833 HydrophobicContact CD2-CG2 3.9Å; Y829-I833 WeakPolarHBondContact CD2-O 3.33Å; Y829-I833 HydrophobicContact CG-CG2 4.36Å; Y829-I833 PolarHBondContact O-N 3.27Å; Y829-P835 HydrophobicContact CE2-CB 4.18Å; Y829-P835 HydrophobicContact CE2-CG 4.04Å; Y829-L838 HydrophobicContact CD1-CD2 3.64Å; Y829-L838 HydrophobicContact CD2-CB 4.43Å; Y829-L838 HydrophobicContact CD2-CD2 3.46Å; Y829-L838 VanDerWaalsContact CD2-CD2 3.46Å; Y829-L838 HydrophobicContact CE1-CD2 3.83Å; Y829-L838 HydrophobicContact CE2-CB 4.47Å; Y829-L838 HydrophobicContact CE2-CD2 3.68Å; Y829-L838 HydrophobicContact CG-CD2 3.45Å; Y829-L838 VanDerWaalsContact CG-CD2 3.45Å
830	R	93.4	Very high	94.8	Very high	32 Å²	32	27.4 Å²	27.4	12%	0.121	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-55.2	-19.8	179.1	-64	171.7	165.1	97.9	-7.6	114	T828 F832 I833 E874 E879	T828-R830 PolarHBondContact O-N 2.78Å; R830-F832 VanDerWaalsContact C-N 3.31Å; R830-I833 WeakPolarHBondContact CA-O 3.46Å; R830-E874 PolarHBondContact NH2-O 3.29Å; R830-E879 WeakPolarHBondContact CD-OE1 3.4Å; R830-E879 IonicContact CZ-OE1 3.37Å; R830-E879 IonicContact CZ-OE2 3.76Å; R830-E879 IonicContact NE-OE1 3.49Å; R830-E879 PolarHBondContact NE-OE1 3.14Å; R830-E879 IonicContact NE-OE2 2.72Å; R830-E879 PolarHBondContact NE-OE2 3.12Å; R830-E879 IonicContact NH2-OE1 3.61Å; R830-E879 IonicContact NH2-OE2 3.45Å; R830-E879 PolarHBondContact NH2-OE2 2.92Å
831	T	93.1	Very high	95.2	Very high	33 Å²	33	26 Å²	26	20%	0.202	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-81.6	-2.7	175.1	66	0	0	0	0	113.9	T828 Y829 L971 R1118	T828-T831 WeakPolarHBondContact O-CB 3.43Å; T828-T831 WeakPolarHBondContact O-CG2 3.18Å; T828-T831 PolarHBondContact O-N 2.57Å; T828-T831 PolarHBondContact O-OG1 2.95Å; Y829-T831 PolarHBondContact O-N 2.94Å; T831-L971 HydrophobicContact CG2-CD2 4.34Å; T831-R1118 PolarHBondContact O-NH2 3.23Å; T831-R1118 PolarHBondContact OG1-NE 3Å
832	F	95.1	Very high	95.3	Very high	49 Å²	49	25.4 Å²	25.4	22%	0.215	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.8	-15.7	178.1	66.2	-99.1	0	0	0	115.8	F825 Y829 R830 V1113 R1118	F825-F832 HydrophobicContact CD2-CZ 4.07Å; F825-F832 HydrophobicContact CE2-CE2 4.25Å; F825-F832 AromaticContact CE2-CZ 3.76Å; F825-F832 HydrophobicContact CE2-CZ 3.76Å; F825-F832 HydrophobicContact CZ-CZ 4.48Å; Y829-F832 PolarHBondContact O-N 3.45Å; R830-F832 VanDerWaalsContact C-N 3.31Å; F832-V1113 HydrophobicContact CB-CG1 3.81Å; F832-V1113 HydrophobicContact CB-CG2 3.99Å; F832-V1113 HydrophobicContact CD1-CG1 3.63Å; F832-V1113 HydrophobicContact CD2-CG1 4.08Å; F832-V1113 HydrophobicContact CD2-CG2 3.92Å; F832-V1113 HydrophobicContact CE1-CG1 4.13Å; F832-V1113 HydrophobicContact CG-CB 4.48Å; F832-V1113 HydrophobicContact CG-CG1 3.59Å; F832-V1113 HydrophobicContact CG-CG2 4.06Å; F832-R1118 HydrophobicContact CD1-CG 4.2Å; F832-R1118 HydrophobicContact CE1-CG 4.22Å
833	I	95.8	Very high	95.4	Very high	23 Å²	23	27.2 Å²	27.2	12%	0.118	13%	0.134	C	C	.	.	S	Bend	trans	-143	144.5	173.8	-173.3	171.7	0	0	0	110.2	Y829 R830 D837 L838 K841	Y829-I833 HydrophobicContact CD2-CG2 3.9Å; Y829-I833 WeakPolarHBondContact CD2-O 3.33Å; Y829-I833 HydrophobicContact CG-CG2 4.36Å; Y829-I833 PolarHBondContact O-N 3.27Å; R830-I833 WeakPolarHBondContact CA-O 3.46Å; I833-D837 HydrophobicContact CD1-CB 4.26Å; I833-D837 HydrophobicContact CG1-CB 4.03Å; I833-L838 HydrophobicContact CD1-CB 4.19Å; I833-L838 HydrophobicContact CG1-CB 4.42Å; I833-L838 HydrophobicContact CG2-CB 4.37Å; I833-K841 HydrophobicContact CD1-CD 3.92Å
834	T	94.6	Very high	95.6	Very high	64 Å²	64	30.7 Å²	30.7	39%	0.393	15%	0.146	S	C	.	.			trans	-72.2	155.5	177.7	77.7	0	0	0	0	111.1	E836 D837 L838	T834-E836 PolarHBondContact O-N 3.15Å; T834-E836 PolarHBondContact OG1-N 2.84Å; T834-D837 PolarHBondContact O-N 2.92Å; T834-D837 WeakPolarHBondContact OG1-CB 3.14Å; T834-D837 PolarHBondContact OG1-N 3.02Å; T834-D837 PolarHBondContact OG1-OD2 3.49Å; T834-L838 WeakPolarHBondContact O-CB 3.44Å; T834-L838 PolarHBondContact O-N 3.36Å
835	P	94.7	Very high	95.6	Very high	18 Å²	18	30.8 Å²	30.8	12%	0.117	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-36.8	172	-20.7	30.8	0	0	0	112.8	Y829 I839 L875 E879	Y829-P835 HydrophobicContact CE2-CB 4.18Å; Y829-P835 HydrophobicContact CE2-CG 4.04Å; P835-I839 WeakPolarHBondContact O-CB 3.28Å; P835-I839 WeakPolarHBondContact O-CD1 3.48Å; P835-I839 WeakPolarHBondContact O-CG1 3.45Å; P835-I839 PolarHBondContact O-N 2.94Å; P835-L875 HydrophobicContact CB-CD2 3.54Å; P835-L875 HydrophobicContact CG-CD2 4.28Å; P835-E879 HydrophobicContact CG-CB 4.43Å; P835-E879 HydrophobicContact CG-CG 4.31Å; P835-E879 WeakPolarHBondContact CG-OE1 3.33Å
836	E	95.3	Very high	95.6	Very high	53 Å²	53	30.9 Å²	30.9	25%	0.248	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-47.9	178.6	-163.8	-172.5	150.4	0	0	111.7	T834 I839 K840 I884 Q887	T834-E836 PolarHBondContact O-N 3.15Å; T834-E836 PolarHBondContact OG1-N 2.84Å; E836-I839 PolarHBondContact O-N 2.98Å; E836-K840 VanDerWaalsContact CD-NZ 3.25Å; E836-K840 WeakPolarHBondContact O-CG 3.28Å; E836-K840 PolarHBondContact O-N 3.44Å; E836-K840 WeakPolarHBondContact OE1-CE 3.31Å; E836-K840 IonicContact OE1-NZ 3.65Å; E836-K840 PolarHBondContact OE1-NZ 3.01Å; E836-I884 HydrophobicContact CB-CD1 3.94Å; E836-I884 HydrophobicContact CB-CG1 3.81Å; E836-I884 HydrophobicContact CG-CD1 4.34Å; E836-I884 HydrophobicContact CG-CG1 3.66Å; E836-Q887 PolarHBondContact OE1-NE2 3.36Å
837	D	96.5	Very high	95.5	Very high	62 Å²	62	33.2 Å²	33.2	33%	0.332	16%	0.162	S	C	.	.	H	α-helix	trans	-73.5	-30.2	-177.4	-56.7	-45.7	0	0	0	112	I833 T834 K840 K841	I833-D837 HydrophobicContact CD1-CB 4.26Å; I833-D837 HydrophobicContact CG1-CB 4.03Å; T834-D837 PolarHBondContact O-N 2.92Å; T834-D837 WeakPolarHBondContact OG1-CB 3.14Å; T834-D837 PolarHBondContact OG1-N 3.02Å; T834-D837 PolarHBondContact OG1-OD2 3.49Å; D837-K840 PolarHBondContact O-N 2.73Å; D837-K840 IonicContact OD1-NZ 3.72Å; D837-K840 PolarHBondContact OD1-NZ 3.22Å; D837-K841 WeakPolarHBondContact O-CB 3.39Å; D837-K841 VanDerWaalsContact O-CG 3.29Å; D837-K841 WeakPolarHBondContact O-CG 3.5Å; D837-K841 PolarHBondContact O-N 2.87Å
838	L	97.4	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-44.6	168.6	180	57	0	0	0	111.4	L807 F825 Y829 I833 T834 K841 L842 V871	L807-L838 HydrophobicContact CD1-CD1 3.59Å; L807-L838 HydrophobicContact CG-CD1 4.08Å; F825-L838 HydrophobicContact CE1-CD1 4.05Å; F825-L838 HydrophobicContact CE1-CD2 4.14Å; F825-L838 HydrophobicContact CZ-CD1 4Å; Y829-L838 HydrophobicContact CD1-CD2 3.64Å; Y829-L838 HydrophobicContact CD2-CB 4.43Å; Y829-L838 HydrophobicContact CD2-CD2 3.46Å; Y829-L838 VanDerWaalsContact CD2-CD2 3.46Å; Y829-L838 HydrophobicContact CE1-CD2 3.83Å; Y829-L838 HydrophobicContact CE2-CB 4.47Å; Y829-L838 HydrophobicContact CE2-CD2 3.68Å; Y829-L838 HydrophobicContact CG-CD2 3.45Å; Y829-L838 VanDerWaalsContact CG-CD2 3.45Å; I833-L838 HydrophobicContact CD1-CB 4.19Å; I833-L838 HydrophobicContact CG1-CB 4.42Å; I833-L838 HydrophobicContact CG2-CB 4.37Å; T834-L838 WeakPolarHBondContact O-CB 3.44Å; T834-L838 PolarHBondContact O-N 3.36Å; L838-K841 PolarHBondContact O-N 2.91Å; L838-L842 HydrophobicContact CD1-CD1 3.81Å; L838-L842 HydrophobicContact CD1-CG 3.98Å; L838-L842 HydrophobicContact CG-CD1 3.84Å; L838-L842 HydrophobicContact CG-CG 4.44Å; L838-L842 WeakPolarHBondContact O-CB 3.3Å; L838-L842 VanDerWaalsContact O-CG 3.3Å; L838-L842 WeakPolarHBondContact O-CG 3.47Å; L838-L842 PolarHBondContact O-N 3.14Å; L838-V871 HydrophobicContact CD2-CG1 4.11Å; L838-V871 HydrophobicContact CD2-CG2 3.64Å; L838-V871 HydrophobicContact CG-CG1 4.44Å; L838-V871 HydrophobicContact CG-CG2 4.18Å
839	I	97.1	Very high	95.4	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-44.7	175.1	-72.9	165.5	0	0	0	110.8	P835 E836 K841 L842 H843 V871 V872 L875 I884 L888	P835-I839 WeakPolarHBondContact O-CB 3.28Å; P835-I839 WeakPolarHBondContact O-CD1 3.48Å; P835-I839 WeakPolarHBondContact O-CG1 3.45Å; P835-I839 PolarHBondContact O-N 2.94Å; E836-I839 PolarHBondContact O-N 2.98Å; I839-K841 PolarHBondContact O-N 3.3Å; I839-L842 PolarHBondContact O-N 2.89Å; I839-H843 WeakPolarHBondContact O-CB 3.48Å; I839-H843 PolarHBondContact O-N 3.24Å; I839-V871 HydrophobicContact CD1-CG1 4.27Å; I839-V871 HydrophobicContact CG1-CG1 3.88Å; I839-V872 HydrophobicContact CD1-CG2 4.23Å; I839-L875 HydrophobicContact CD1-CD1 4.25Å; I839-I884 HydrophobicContact CD1-CG2 3.93Å; I839-L888 HydrophobicContact CD1-CD1 4.47Å; I839-L888 HydrophobicContact CD1-CD2 4.42Å; I839-L888 HydrophobicContact CG2-CD2 3.7Å; I839-L888 HydrophobicContact CG2-CG 4.46Å
840	K	96.1	Very high	95.1	Very high	77 Å²	77	36.7 Å²	36.7	34%	0.335	18%	0.183	S	C	.	.	H	α-helix	trans	-57.4	-47.7	174.9	-71.4	169.7	-167.3	148.3	0	112.1	E836 D837 H843 Y844 Q887	E836-K840 VanDerWaalsContact CD-NZ 3.25Å; E836-K840 WeakPolarHBondContact O-CG 3.28Å; E836-K840 PolarHBondContact O-N 3.44Å; E836-K840 WeakPolarHBondContact OE1-CE 3.31Å; E836-K840 IonicContact OE1-NZ 3.65Å; E836-K840 PolarHBondContact OE1-NZ 3.01Å; D837-K840 PolarHBondContact O-N 2.73Å; D837-K840 IonicContact OD1-NZ 3.72Å; D837-K840 PolarHBondContact OD1-NZ 3.22Å; K840-H843 PolarHBondContact O-N 3.37Å; K840-Y844 WeakPolarHBondContact O-CB 3.4Å; K840-Y844 PolarHBondContact O-N 3.38Å; K840-Q887 VanDerWaalsContact CG-OE1 3.27Å
841	K	97.7	Very high	94.8	Very high	60 Å²	60	41.3 Å²	41.3	26%	0.261	21%	0.205	S	C	.	.	H	α-helix	trans	-70.6	-38.3	-177.5	-71.6	-179.3	169.2	-160.4	0	113	L774 D804 L807 I833 D837 L838 I839 Y844 R845	L774-K841 HydrophobicContact CD1-CB 3.9Å; L774-K841 HydrophobicContact CD1-CD 4.28Å; L774-K841 HydrophobicContact CD1-CG 3.84Å; L774-K841 HydrophobicContact CD2-CB 4.38Å; D804-K841 WeakPolarHBondContact OD1-CD 3.46Å; D804-K841 WeakPolarHBondContact OD1-CE 3.43Å; D804-K841 IonicContact OD1-NZ 3.29Å; D804-K841 PolarHBondContact OD1-NZ 2.8Å; D804-K841 IonicContact OD2-NZ 3.45Å; D804-K841 PolarHBondContact OD2-NZ 3.26Å; L807-K841 HydrophobicContact CD1-CB 3.55Å; L807-K841 HydrophobicContact CD1-CD 4.42Å; I833-K841 HydrophobicContact CD1-CD 3.92Å; D837-K841 WeakPolarHBondContact O-CB 3.39Å; D837-K841 VanDerWaalsContact O-CG 3.29Å; D837-K841 WeakPolarHBondContact O-CG 3.5Å; D837-K841 PolarHBondContact O-N 2.87Å; L838-K841 PolarHBondContact O-N 2.91Å; I839-K841 PolarHBondContact O-N 3.3Å; K841-Y844 PolarHBondContact O-N 2.89Å; K841-R845 WeakPolarHBondContact O-CB 3.47Å; K841-R845 PolarHBondContact O-N 3.01Å
842	L	97.6	Very high	94.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-39.5	171.4	-70.2	168.9	0	0	0	111.7	L807 T811 L838 I839 Y846 T864 V867 L868 V871	L807-L842 HydrophobicContact CD1-CD2 4.34Å; L807-L842 HydrophobicContact CD1-CG 4.28Å; L807-L842 HydrophobicContact CD2-CD2 3.77Å; L807-L842 HydrophobicContact CG-CD2 3.94Å; L807-L842 HydrophobicContact CG-CG 4.39Å; T811-L842 HydrophobicContact CG2-CD2 3.74Å; L838-L842 HydrophobicContact CD1-CD1 3.81Å; L838-L842 HydrophobicContact CD1-CG 3.98Å; L838-L842 HydrophobicContact CG-CD1 3.84Å; L838-L842 HydrophobicContact CG-CG 4.44Å; L838-L842 WeakPolarHBondContact O-CB 3.3Å; L838-L842 VanDerWaalsContact O-CG 3.3Å; L838-L842 WeakPolarHBondContact O-CG 3.47Å; L838-L842 PolarHBondContact O-N 3.14Å; I839-L842 PolarHBondContact O-N 2.89Å; L842-Y846 VanDerWaalsContact O-CB 3.3Å; L842-Y846 WeakPolarHBondContact O-CB 3.39Å; L842-Y846 PolarHBondContact O-N 2.95Å; L842-T864 HydrophobicContact CB-CG2 4.27Å; L842-T864 HydrophobicContact CD2-CG2 3.83Å; L842-T864 WeakPolarHBondContact O-CG2 3.22Å; L842-V867 HydrophobicContact CD1-CG1 4.07Å; L842-V867 HydrophobicContact CD2-CB 4.39Å; L842-V867 HydrophobicContact CD2-CG1 3.98Å; L842-L868 HydrophobicContact CB-CB 4.07Å; L842-L868 HydrophobicContact CB-CD1 3.99Å; L842-L868 HydrophobicContact CB-CG 4.32Å; L842-L868 HydrophobicContact CD1-CB 4.23Å; L842-V871 HydrophobicContact CD1-CG2 3.87Å
843	H	95.4	Very high	94.1	Very high	56 Å²	56	44.5 Å²	44.5	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-65.2	-42.2	174.7	177.6	-153.2	0	0	0	112	I839 K840 Y846 T847 L868	I839-H843 WeakPolarHBondContact O-CB 3.48Å; I839-H843 PolarHBondContact O-N 3.24Å; K840-H843 PolarHBondContact O-N 3.37Å; H843-Y846 WeakPolarHBondContact O-CB 3.33Å; H843-Y846 PolarHBondContact O-N 3.49Å; H843-T847 PolarHBondContact O-N 3.19Å; H843-T847 PolarHBondContact O-OG1 2.86Å; H843-T847 VanDerWaalsContact O-OG1 3.1Å; H843-L868 HydrophobicContact CB-CD1 4.17Å
844	Y	96	Very high	93.9	Very high	107 Å²	107	46.4 Å²	46.4	42%	0.42	24%	0.242	S	C	.	.	H	α-helix	trans	-58	-58.3	172.6	178	-101	0	0	0	111.1	D772 L774 K840 K841 Y846 T847 T848	D772-Y844 WeakPolarHBondContact OD2-CE1 3.49Å; D772-Y844 PolarHBondContact OD2-OH 3.48Å; L774-Y844 HydrophobicContact CB-CD1 3.85Å; L774-Y844 HydrophobicContact CB-CE1 3.95Å; L774-Y844 HydrophobicContact CD1-CD1 3.76Å; L774-Y844 HydrophobicContact CD1-CE1 4.36Å; L774-Y844 HydrophobicContact CG-CD1 4.47Å; K840-Y844 WeakPolarHBondContact O-CB 3.4Å; K840-Y844 PolarHBondContact O-N 3.38Å; K841-Y844 PolarHBondContact O-N 2.89Å; Y844-Y846 PolarHBondContact O-N 3.24Å; Y844-Y846 VanDerWaalsContact O-N 3.13Å; Y844-T847 PolarHBondContact O-N 2.81Å; Y844-T847 PolarHBondContact O-OG1 3.25Å; Y844-T848 PolarHBondContact O-N 3.46Å; Y844-T848 PolarHBondContact O-OG1 3.42Å; Y844-T848 VanDerWaalsContact O-OG1 3.09Å
845	R	96.2	Very high	93.7	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-27.9	178.9	-177.7	169.6	171.6	80.3	-6.8	113.3	L774 L776 T811 K841 F849 T864	L774-R845 WeakPolarHBondContact O-CG 3.49Å; L774-R845 PolarHBondContact O-NH1 2.98Å; L776-R845 PolarHBondContact O-NH1 2.96Å; L776-R845 PolarHBondContact O-NH2 2.99Å; L776-R845 VanDerWaalsContact O-NH2 3.08Å; T811-R845 PolarHBondContact OG1-NE 3.35Å; K841-R845 WeakPolarHBondContact O-CB 3.47Å; K841-R845 PolarHBondContact O-N 3.01Å; R845-F849 HydrophobicContact CG-CD2 4.32Å; R845-F849 HydrophobicContact CG-CE2 3.94Å; R845-F849 WeakPolarHBondContact O-CD2 3.41Å; R845-T864 HydrophobicContact CB-CG2 3.97Å; R845-T864 HydrophobicContact CG-CG2 3.98Å
846	Y	95.3	Very high	93.5	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-53.8	169.6	174.1	-103.6	0	0	0	112	L842 H843 Y844 T848 F849 C850 S861 F865 L895 E900 L903	L842-Y846 VanDerWaalsContact O-CB 3.3Å; L842-Y846 WeakPolarHBondContact O-CB 3.39Å; L842-Y846 PolarHBondContact O-N 2.95Å; H843-Y846 WeakPolarHBondContact O-CB 3.33Å; H843-Y846 PolarHBondContact O-N 3.49Å; Y844-Y846 PolarHBondContact O-N 3.24Å; Y844-Y846 VanDerWaalsContact O-N 3.13Å; Y846-T848 VanDerWaalsContact C-N 3.35Å; Y846-T848 PolarHBondContact O-N 2.79Å; Y846-F849 PolarHBondContact O-N 3.11Å; Y846-F849 VanDerWaalsContact O-N 3.15Å; Y846-C850 HydrophobicContact CD2-CB 4.42Å; Y846-C850 HydrophobicContact CE1-CB 4.06Å; Y846-C850 HydrophobicContact CE2-CB 3.93Å; Y846-C850 PolarHBondContact O-N 3.33Å; Y846-S861 VanDerWaalsContact CD2-O 3.31Å; Y846-S861 WeakPolarHBondContact CD2-O 3.45Å; Y846-F865 HydrophobicContact CD2-CB 3.76Å; Y846-F865 HydrophobicContact CD2-CD2 4Å; Y846-F865 HydrophobicContact CD2-CG 4.3Å; Y846-F865 HydrophobicContact CE2-CB 3.87Å; Y846-F865 AromaticContact CE2-CD2 3.93Å; Y846-F865 HydrophobicContact CE2-CD2 3.93Å; Y846-F865 HydrophobicContact CE2-CG 4.14Å; Y846-F865 HydrophobicContact CG-CD2 4.35Å; Y846-L895 HydrophobicContact CE1-CD2 3.8Å; Y846-L895 WeakPolarHBondContact OH-CD2 3.5Å; Y846-E900 PolarHBondContact OH-OE1 2.86Å; Y846-E900 PolarHBondContact OH-OE2 3.01Å; Y846-E900 VanDerWaalsContact OH-OE2 3.11Å; Y846-L903 HydrophobicContact CE2-CD1 4.33Å
847	T	93.2	Very high	93.4	Very high	49 Å²	49	52.3 Å²	52.3	30%	0.301	27%	0.27	S	S	.	.	H	α-helix	trans	-65.8	-34.2	-175.6	51.8	0	0	0	0	113.1	H843 Y844 F849	H843-T847 PolarHBondContact O-N 3.19Å; H843-T847 PolarHBondContact O-OG1 2.86Å; H843-T847 VanDerWaalsContact O-OG1 3.1Å; Y844-T847 PolarHBondContact O-N 2.81Å; Y844-T847 PolarHBondContact O-OG1 3.25Å; T847-F849 PolarHBondContact O-N 3.31Å; T847-F849 VanDerWaalsContact O-N 3.14Å
848	T	93.6	Very high	93.1	Very high	58 Å²	58	53.6 Å²	53.6	36%	0.356	27%	0.272	S	S	.	.	H	α-helix	trans	-57.6	-25.6	173.7	-57.1	0	0	0	0	113.4	Y844 Y846	Y844-T848 PolarHBondContact O-N 3.46Å; Y844-T848 PolarHBondContact O-OG1 3.42Å; Y844-T848 VanDerWaalsContact O-OG1 3.09Å; Y846-T848 VanDerWaalsContact C-N 3.35Å; Y846-T848 PolarHBondContact O-N 2.79Å
849	F	93.5	Very high	92.7	Very high	7 Å²	7	59.3 Å²	59.3	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-121.3	-22.8	-172.9	-60	-42	0	0	0	116.1	S775 I777 R845 Y846 T847 H851 S852 K857 V860	S775-F849 WeakPolarHBondContact O-CZ 3.4Å; I777-F849 HydrophobicContact CD1-CD1 4.15Å; I777-F849 HydrophobicContact CD1-CE1 3.45Å; I777-F849 VanDerWaalsContact CD1-CE1 3.45Å; I777-F849 HydrophobicContact CD1-CE2 4.37Å; I777-F849 HydrophobicContact CD1-CZ 3.58Å; I777-F849 HydrophobicContact CG1-CE1 4.12Å; I777-F849 HydrophobicContact CG1-CE2 4.5Å; I777-F849 HydrophobicContact CG1-CZ 3.76Å; R845-F849 HydrophobicContact CG-CD2 4.32Å; R845-F849 HydrophobicContact CG-CE2 3.94Å; R845-F849 WeakPolarHBondContact O-CD2 3.41Å; Y846-F849 PolarHBondContact O-N 3.11Å; Y846-F849 VanDerWaalsContact O-N 3.15Å; T847-F849 PolarHBondContact O-N 3.31Å; T847-F849 VanDerWaalsContact O-N 3.14Å; F849-H851 VanDerWaalsContact C-N 3.32Å; F849-H851 PolarHBondContact O-N 3.43Å; F849-S852 VanDerWaalsContact O-CB 3.25Å; F849-S852 WeakPolarHBondContact O-CB 3.38Å; F849-S852 PolarHBondContact O-N 2.78Å; F849-S852 VanDerWaalsContact O-N 3.08Å; F849-K857 HydrophobicContact CB-CB 4.29Å; F849-K857 HydrophobicContact CD1-CB 4.31Å; F849-K857 HydrophobicContact CD1-CD 4.3Å; F849-K857 HydrophobicContact CD1-CG 4.11Å; F849-K857 HydrophobicContact CG-CB 4.49Å; F849-V860 HydrophobicContact CD2-CG1 3.99Å; F849-V860 HydrophobicContact CE2-CG1 4.08Å
850	C	89.8	Confident	92.5	Very high	12 Å²	12	59.1 Å²	59.1	8%	0.081	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-36.4	-173.2	58.4	0	0	0	0	113.9	Y846	Y846-C850 HydrophobicContact CD2-CB 4.42Å; Y846-C850 HydrophobicContact CE1-CB 4.06Å; Y846-C850 HydrophobicContact CE2-CB 3.93Å; Y846-C850 PolarHBondContact O-N 3.33Å
851	H	87.3	Confident	92.4	Very high	130 Å²	130	55.6 Å²	55.6	60%	0.602	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.9	177.6	-54.9	99.7	0	0	0	114.4	F849 N898	F849-H851 VanDerWaalsContact C-N 3.32Å; F849-H851 PolarHBondContact O-N 3.43Å; H851-N898 PolarHBondContact CE1-ND2 3Å; H851-N898 PolarHBondContact NE2-ND2 2.91Å; H851-N898 PolarHBondContact NE2-OD1 3.38Å
852	S	88.5	Confident	92.2	Very high	26 Å²	26	57.7 Å²	57.7	18%	0.182	29%	0.287	C	S	.	.			trans	-61.3	139.6	-178.4	-164.8	0	0	0	0	111.3	F849 D854 K857 K858	F849-S852 VanDerWaalsContact O-CB 3.25Å; F849-S852 WeakPolarHBondContact O-CB 3.38Å; F849-S852 PolarHBondContact O-N 2.78Å; F849-S852 VanDerWaalsContact O-N 3.08Å; S852-D854 PolarHBondContact O-N 3.23Å; S852-K857 WeakPolarHBondContact OG-CD 3.3Å; S852-K858 WeakPolarHBondContact O-CE 3.34Å
853	P	84.9	Confident	92	Very high	123 Å²	123	59.9 Å²	59.9	80%	0.799	30%	0.299	S	S	*	.	S	Bend	trans	-67.9	-23.2	176.2	27.7	-35	0	0	0	113
854	D	91.2	Very high	92	Very high	62 Å²	62	57.2 Å²	57.2	33%	0.332	29%	0.286	S	S	.	.			trans	-68.5	129.9	-177.8	171.5	20.2	0	0	0	112.6	S852 F856 K857 K858	S852-D854 PolarHBondContact O-N 3.23Å; D854-F856 VanDerWaalsContact C-N 3.3Å; D854-F856 PolarHBondContact O-N 3.03Å; D854-F856 PolarHBondContact OD1-N 2.99Å; D854-K857 HydrophobicContact CB-CB 4.13Å; D854-K857 HydrophobicContact CB-CD 4.16Å; D854-K857 HydrophobicContact CB-CG 4.29Å; D854-K857 PolarHBondContact O-N 3.45Å; D854-K857 VanDerWaalsContact OD2-CG 3.26Å; D854-K857 WeakPolarHBondContact OD2-CG 3.46Å; D854-K857 PolarHBondContact OD2-N 3.18Å; D854-K858 WeakPolarHBondContact O-CG 3.37Å; D854-K858 PolarHBondContact O-N 2.63Å
855	T	90.8	Very high	92	Very high	108 Å²	108	52.2 Å²	52.2	66%	0.663	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.2	-179.3	66	0	0	0	0	113.3	R859	T855-R859 PolarHBondContact O-N 2.98Å
856	F	90.4	Very high	91.9	Very high	77 Å²	77	57.6 Å²	57.6	34%	0.338	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-48.7	174.6	-176.8	-114.2	0	0	0	110.8	I777 D854 K858 R859 V860	I777-F856 HydrophobicContact CB-CE1 4.31Å; I777-F856 HydrophobicContact CG2-CD1 4.2Å; I777-F856 HydrophobicContact CG2-CE1 3.54Å; I777-F856 HydrophobicContact CG2-CZ 4.26Å; D854-F856 VanDerWaalsContact C-N 3.3Å; D854-F856 PolarHBondContact O-N 3.03Å; D854-F856 PolarHBondContact OD1-N 2.99Å; F856-K858 VanDerWaalsContact C-N 3.29Å; F856-K858 PolarHBondContact O-N 3.35Å; F856-R859 WeakPolarHBondContact O-CA 3.44Å; F856-R859 WeakPolarHBondContact O-CB 3.04Å; F856-R859 PolarHBondContact O-N 2.83Å; F856-V860 HydrophobicContact CE1-CG2 4.48Å; F856-V860 HydrophobicContact CZ-CG2 4.42Å; F856-V860 PolarHBondContact O-N 3.42Å
857	K	92.1	Very high	92	Very high	75 Å²	75	57.8 Å²	57.8	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-40.2	171.1	-72.9	173.1	-167.6	-157.9	0	112.8	I777 F849 S852 D854 R859 V860 S861	I777-K857 HydrophobicContact CD1-CD 4Å; I777-K857 HydrophobicContact CD1-CG 3.59Å; F849-K857 HydrophobicContact CB-CB 4.29Å; F849-K857 HydrophobicContact CD1-CB 4.31Å; F849-K857 HydrophobicContact CD1-CD 4.3Å; F849-K857 HydrophobicContact CD1-CG 4.11Å; F849-K857 HydrophobicContact CG-CB 4.49Å; S852-K857 WeakPolarHBondContact OG-CD 3.3Å; D854-K857 HydrophobicContact CB-CB 4.13Å; D854-K857 HydrophobicContact CB-CD 4.16Å; D854-K857 HydrophobicContact CB-CG 4.29Å; D854-K857 PolarHBondContact O-N 3.45Å; D854-K857 VanDerWaalsContact OD2-CG 3.26Å; D854-K857 WeakPolarHBondContact OD2-CG 3.46Å; D854-K857 PolarHBondContact OD2-N 3.18Å; K857-R859 VanDerWaalsContact C-N 3.26Å; K857-R859 PolarHBondContact O-N 3.28Å; K857-V860 PolarHBondContact O-N 3.15Å; K857-S861 PolarHBondContact O-N 3.28Å
858	K	89.9	Confident	92.1	Very high	88 Å²	88	55.5 Å²	55.5	38%	0.383	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-17	171.4	-71	-172.4	-168.8	-168.7	0	115.3	S852 D854 F856 S861 K862	S852-K858 WeakPolarHBondContact O-CE 3.34Å; D854-K858 WeakPolarHBondContact O-CG 3.37Å; D854-K858 PolarHBondContact O-N 2.63Å; F856-K858 VanDerWaalsContact C-N 3.29Å; F856-K858 PolarHBondContact O-N 3.35Å; K858-S861 PolarHBondContact O-OG 3.17Å; K858-K862 WeakPolarHBondContact O-CD 3.26Å; K858-K862 VanDerWaalsContact O-CG 3.32Å; K858-K862 WeakPolarHBondContact O-CG 3.44Å
859	R	91	Very high	92.3	Very high	120 Å²	120	53.7 Å²	53.7	45%	0.453	27%	0.267	S	S	.	.	H	α-helix	trans	-81.7	-46	173.1	-165.3	-177.7	-64.2	-171.9	-2.2	109.7	T813 E814 T855 F856 K857 K862 N863	T813-R859 HydrophobicContact CG2-CG 4.09Å; E814-R859 VanDerWaalsContact OE1-CD 3.29Å; E814-R859 WeakPolarHBondContact OE1-CD 3.49Å; E814-R859 IonicContact OE1-CZ 2.73Å; E814-R859 IonicContact OE1-NE 3.7Å; E814-R859 IonicContact OE1-NH1 3.85Å; E814-R859 PolarHBondContact OE1-NH1 3.22Å; E814-R859 IonicContact OE2-NH1 2.71Å; E814-R859 PolarHBondContact OE2-NH1 3.19Å; E814-R859 VanDerWaalsContact OE2-NH1 3.16Å; T855-R859 PolarHBondContact O-N 2.98Å; F856-R859 WeakPolarHBondContact O-CA 3.44Å; F856-R859 WeakPolarHBondContact O-CB 3.04Å; F856-R859 PolarHBondContact O-N 2.83Å; K857-R859 VanDerWaalsContact C-N 3.26Å; K857-R859 PolarHBondContact O-N 3.28Å; R859-K862 PolarHBondContact O-N 3.03Å; R859-N863 PolarHBondContact O-N 3.09Å
860	V	92.6	Very high	92.3	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-46	176.1	176.1	0	0	0	0	111.3	I777 T813 F849 F856 K857 K862 N863 T864	I777-V860 HydrophobicContact CG2-CB 4.37Å; I777-V860 HydrophobicContact CG2-CG1 4.28Å; I777-V860 HydrophobicContact CG2-CG2 3.69Å; T813-V860 HydrophobicContact CG2-CG2 4.22Å; F849-V860 HydrophobicContact CD2-CG1 3.99Å; F849-V860 HydrophobicContact CE2-CG1 4.08Å; F856-V860 HydrophobicContact CE1-CG2 4.48Å; F856-V860 HydrophobicContact CZ-CG2 4.42Å; F856-V860 PolarHBondContact O-N 3.42Å; K857-V860 PolarHBondContact O-N 3.15Å; V860-K862 VanDerWaalsContact C-N 3.31Å; V860-K862 PolarHBondContact O-N 3.21Å; V860-N863 PolarHBondContact O-N 2.9Å; V860-T864 PolarHBondContact O-N 3.15Å; V860-T864 PolarHBondContact O-OG1 2.96Å; V860-T864 VanDerWaalsContact O-OG1 3.08Å
861	S	93.9	Very high	92.6	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-55.4	-46.2	176.2	73.6	0	0	0	0	111.9	Y846 K857 K858 N863 T864 F865	Y846-S861 VanDerWaalsContact CD2-O 3.31Å; Y846-S861 WeakPolarHBondContact CD2-O 3.45Å; K857-S861 PolarHBondContact O-N 3.28Å; K858-S861 PolarHBondContact O-OG 3.17Å; S861-N863 VanDerWaalsContact C-N 3.33Å; S861-N863 PolarHBondContact O-N 3.28Å; S861-T864 PolarHBondContact O-N 3.17Å; S861-F865 WeakPolarHBondContact O-CB 3.33Å; S861-F865 PolarHBondContact O-N 3.33Å
862	K	92.3	Very high	92.9	Very high	103 Å²	103	50.1 Å²	50.1	45%	0.448	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-37.7	177.6	-71.2	174.6	-175.6	178.1	0	112.4	K858 R859 V860 F865 F866	K858-K862 WeakPolarHBondContact O-CD 3.26Å; K858-K862 VanDerWaalsContact O-CG 3.32Å; K858-K862 WeakPolarHBondContact O-CG 3.44Å; R859-K862 PolarHBondContact O-N 3.03Å; V860-K862 VanDerWaalsContact C-N 3.31Å; V860-K862 PolarHBondContact O-N 3.21Å; K862-F865 WeakPolarHBondContact O-CB 3.4Å; K862-F865 PolarHBondContact O-N 3.06Å; K862-F866 HydrophobicContact CB-CE2 4.34Å; K862-F866 WeakPolarHBondContact O-CD2 3.39Å; K862-F866 WeakPolarHBondContact O-CG 3.42Å; K862-F866 PolarHBondContact O-N 3.07Å
863	N	93.3	Very high	93.1	Very high	47 Å²	47	53.2 Å²	53.2	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-47.8	176.8	-158.7	52.6	0	0	0	111.4	T811 E812 T813 R859 V860 S861 F865 F866 V867	T811-N863 VanDerWaalsContact C-ND2 3.29Å; T811-N863 PolarHBondContact O-ND2 3.38Å; E812-N863 PolarHBondContact O-ND2 3.34Å; T813-N863 HydrophobicContact CG2-CB 3.55Å; R859-N863 PolarHBondContact O-N 3.09Å; V860-N863 PolarHBondContact O-N 2.9Å; S861-N863 VanDerWaalsContact C-N 3.33Å; S861-N863 PolarHBondContact O-N 3.28Å; N863-F865 PolarHBondContact O-N 3.1Å; N863-F866 PolarHBondContact O-N 2.93Å; N863-V867 WeakPolarHBondContact O-CG2 3.39Å; N863-V867 PolarHBondContact O-N 3.29Å
864	T	96.1	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-53.4	-40.4	170.4	-55.7	0	0	0	0	111.8	T811 L842 R845 V860 S861 V867 L868	T811-T864 HydrophobicContact CG2-CG2 4.25Å; L842-T864 HydrophobicContact CB-CG2 4.27Å; L842-T864 HydrophobicContact CD2-CG2 3.83Å; L842-T864 WeakPolarHBondContact O-CG2 3.22Å; R845-T864 HydrophobicContact CB-CG2 3.97Å; R845-T864 HydrophobicContact CG-CG2 3.98Å; V860-T864 PolarHBondContact O-N 3.15Å; V860-T864 PolarHBondContact O-OG1 2.96Å; V860-T864 VanDerWaalsContact O-OG1 3.08Å; S861-T864 PolarHBondContact O-N 3.17Å; T864-V867 PolarHBondContact O-N 3.01Å; T864-L868 PolarHBondContact O-N 3.38Å
865	F	95.9	Very high	93.2	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-39.7	176	-168.1	-96.1	0	0	0	113.3	Y846 S861 K862 N863 V867 L868 V869 L891 L895 L903 L907	Y846-F865 HydrophobicContact CD2-CB 3.76Å; Y846-F865 HydrophobicContact CD2-CD2 4Å; Y846-F865 HydrophobicContact CD2-CG 4.3Å; Y846-F865 HydrophobicContact CE2-CB 3.87Å; Y846-F865 AromaticContact CE2-CD2 3.93Å; Y846-F865 HydrophobicContact CE2-CD2 3.93Å; Y846-F865 HydrophobicContact CE2-CG 4.14Å; Y846-F865 HydrophobicContact CG-CD2 4.35Å; S861-F865 WeakPolarHBondContact O-CB 3.33Å; S861-F865 PolarHBondContact O-N 3.33Å; K862-F865 WeakPolarHBondContact O-CB 3.4Å; K862-F865 PolarHBondContact O-N 3.06Å; N863-F865 PolarHBondContact O-N 3.1Å; F865-V867 VanDerWaalsContact C-N 3.35Å; F865-L868 WeakPolarHBondContact O-CB 3.26Å; F865-L868 PolarHBondContact O-N 3.46Å; F865-V869 HydrophobicContact CD1-CG2 3.95Å; F865-V869 HydrophobicContact CE1-CG2 3.51Å; F865-V869 HydrophobicContact CZ-CG2 4.01Å; F865-V869 WeakPolarHBondContact O-CG2 3.39Å; F865-V869 PolarHBondContact O-N 3.29Å; F865-L891 HydrophobicContact CE2-CD2 4.35Å; F865-L895 HydrophobicContact CE2-CD1 3.62Å; F865-L895 HydrophobicContact CE2-CD2 4.26Å; F865-L895 HydrophobicContact CZ-CD1 3.63Å; F865-L903 HydrophobicContact CD1-CB 4.2Å; F865-L903 HydrophobicContact CD1-CD1 4.07Å; F865-L903 HydrophobicContact CD1-CD2 3.86Å; F865-L903 HydrophobicContact CD1-CG 4.26Å; F865-L903 HydrophobicContact CE1-CB 3.63Å; F865-L903 HydrophobicContact CE1-CD1 4.34Å; F865-L903 HydrophobicContact CE1-CD2 3.98Å; F865-L903 HydrophobicContact CE1-CG 4.18Å; F865-L903 HydrophobicContact CG-CD1 4.24Å; F865-L903 HydrophobicContact CZ-CB 3.89Å; F865-L907 HydrophobicContact CE2-CD2 4.14Å; F865-L907 HydrophobicContact CZ-CB 3.85Å; F865-L907 HydrophobicContact CZ-CD2 4.02Å
866	F	95	Very high	92.9	Very high	115 Å²	115	42 Å²	42	50%	0.504	19%	0.189	S	C	.	.	H	α-helix	trans	-67	-36.3	175.1	-68.9	-54.7	0	0	0	112.1	K862 N863 V869 R870	K862-F866 HydrophobicContact CB-CE2 4.34Å; K862-F866 WeakPolarHBondContact O-CD2 3.39Å; K862-F866 WeakPolarHBondContact O-CG 3.42Å; K862-F866 PolarHBondContact O-N 3.07Å; N863-F866 PolarHBondContact O-N 2.93Å; F866-V869 PolarHBondContact O-N 3.45Å; F866-R870 PolarHBondContact O-N 3.44Å
867	V	95.9	Very high	92.5	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-41.6	171.2	176.5	0	0	0	0	110.9	T811 L826 L842 N863 T864 F865 R870 V871	T811-V867 HydrophobicContact CG2-CB 4.04Å; T811-V867 HydrophobicContact CG2-CG1 4.18Å; T811-V867 HydrophobicContact CG2-CG2 3.98Å; L826-V867 HydrophobicContact CD2-CG1 4.22Å; L842-V867 HydrophobicContact CD1-CG1 4.07Å; L842-V867 HydrophobicContact CD2-CB 4.39Å; L842-V867 HydrophobicContact CD2-CG1 3.98Å; N863-V867 WeakPolarHBondContact O-CG2 3.39Å; N863-V867 PolarHBondContact O-N 3.29Å; T864-V867 PolarHBondContact O-N 3.01Å; F865-V867 VanDerWaalsContact C-N 3.35Å; V867-R870 PolarHBondContact O-N 3.26Å; V867-V871 WeakPolarHBondContact O-CG2 3.45Å; V867-V871 PolarHBondContact O-N 3.39Å
868	L	97.1	Very high	92	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-47.7	173	-173	156.4	0	0	0	111.8	L842 H843 T864 F865 R870 V871 V872 L888 L891 L907	L842-L868 HydrophobicContact CB-CB 4.07Å; L842-L868 HydrophobicContact CB-CD1 3.99Å; L842-L868 HydrophobicContact CB-CG 4.32Å; L842-L868 HydrophobicContact CD1-CB 4.23Å; H843-L868 HydrophobicContact CB-CD1 4.17Å; T864-L868 PolarHBondContact O-N 3.38Å; F865-L868 WeakPolarHBondContact O-CB 3.26Å; F865-L868 PolarHBondContact O-N 3.46Å; L868-R870 VanDerWaalsContact C-N 3.26Å; L868-R870 PolarHBondContact O-N 3.05Å; L868-V871 PolarHBondContact O-N 3.15Å; L868-V871 VanDerWaalsContact O-N 3.16Å; L868-V872 HydrophobicContact CD2-CG2 4.11Å; L868-V872 WeakPolarHBondContact O-CG2 3.4Å; L868-V872 PolarHBondContact O-N 3.44Å; L868-L888 HydrophobicContact CD2-CD2 4.24Å; L868-L891 HydrophobicContact CD1-CD2 3.8Å; L868-L891 HydrophobicContact CD2-CD2 4.05Å; L868-L907 HydrophobicContact CD2-CD1 4.01Å; L868-L907 HydrophobicContact CD2-CD2 4.3Å
869	V	95.9	Very high	91.8	Very high	20 Å²	20	37.7 Å²	37.7	12%	0.121	18%	0.179	C	C	.	.	H	α-helix	trans	-58.8	-38.8	176.6	168.3	0	0	0	0	111.3	F865 F866 V872 D873 V906 L907	F865-V869 HydrophobicContact CD1-CG2 3.95Å; F865-V869 HydrophobicContact CE1-CG2 3.51Å; F865-V869 HydrophobicContact CZ-CG2 4.01Å; F865-V869 WeakPolarHBondContact O-CG2 3.39Å; F865-V869 PolarHBondContact O-N 3.29Å; F866-V869 PolarHBondContact O-N 3.45Å; V869-V872 PolarHBondContact O-N 2.73Å; V869-D873 WeakPolarHBondContact O-CB 3.33Å; V869-D873 PolarHBondContact O-N 3.25Å; V869-V906 HydrophobicContact CG1-CG1 3.88Å; V869-V906 HydrophobicContact CG2-CG1 4.23Å; V869-L907 HydrophobicContact CG2-CB 4.33Å; V869-L907 HydrophobicContact CG2-CD1 4.43Å
870	R	95.1	Very high	91.7	Very high	74 Å²	74	32.3 Å²	32.3	28%	0.279	16%	0.159	S	C	.	.	H	α-helix	trans	-66.4	-42.2	173.8	-78	-166.4	65.2	174.9	-0.6	113.5	E823 L826 F866 V867 L868 V872 D873 E874	E823-R870 IonicContact OE1-CZ 2.65Å; E823-R870 IonicContact OE1-NH1 2.75Å; E823-R870 PolarHBondContact OE1-NH1 3.48Å; E823-R870 IonicContact OE1-NH2 3.98Å; E823-R870 PolarHBondContact OE1-NH2 2.97Å; E823-R870 IonicContact OE2-NH2 3.92Å; L826-R870 HydrophobicContact CD1-CB 4.05Å; L826-R870 VanDerWaalsContact CD1-CZ 3.42Å; F866-R870 PolarHBondContact O-N 3.44Å; V867-R870 PolarHBondContact O-N 3.26Å; L868-R870 VanDerWaalsContact C-N 3.26Å; L868-R870 PolarHBondContact O-N 3.05Å; R870-V872 PolarHBondContact O-N 3.33Å; R870-D873 PolarHBondContact O-N 3Å; R870-E874 IonicContact CZ-OE1 2.75Å; R870-E874 VanDerWaalsContact CZ-OE1 3.29Å; R870-E874 IonicContact NE-OE1 3.62Å; R870-E874 PolarHBondContact NE-OE1 3.05Å; R870-E874 IonicContact NH2-OE1 2.69Å; R870-E874 PolarHBondContact NH2-OE1 2.73Å; R870-E874 WeakPolarHBondContact O-CB 3.47Å; R870-E874 WeakPolarHBondContact O-CG 3.35Å; R870-E874 PolarHBondContact O-N 3.07Å
871	V	95.4	Very high	91.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-41.4	174.6	172	0	0	0	0	110.6	L826 L838 I839 L842 V867 L868 E874 L875	L826-V871 HydrophobicContact CD2-CG2 3.5Å; L826-V871 VanDerWaalsContact CD2-CG2 3.5Å; L838-V871 HydrophobicContact CD2-CG1 4.11Å; L838-V871 HydrophobicContact CD2-CG2 3.64Å; L838-V871 HydrophobicContact CG-CG1 4.44Å; L838-V871 HydrophobicContact CG-CG2 4.18Å; I839-V871 HydrophobicContact CD1-CG1 4.27Å; I839-V871 HydrophobicContact CG1-CG1 3.88Å; L842-V871 HydrophobicContact CD1-CG2 3.87Å; V867-V871 WeakPolarHBondContact O-CG2 3.45Å; V867-V871 PolarHBondContact O-N 3.39Å; L868-V871 PolarHBondContact O-N 3.15Å; L868-V871 VanDerWaalsContact O-N 3.16Å; V871-E874 CarbonylContact O-C 3.58Å; V871-E874 PolarHBondContact O-N 3.15Å; V871-L875 WeakPolarHBondContact O-CG 3.44Å; V871-L875 PolarHBondContact O-N 3.07Å; V871-L875 VanDerWaalsContact O-N 3.1Å
872	V	94.1	Very high	91.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-69.7	-39.2	177	-176.5	0	0	0	0	112.2	I839 L868 V869 R870 E874 L875 L888 L907 N910 I911 K914	I839-V872 HydrophobicContact CD1-CG2 4.23Å; L868-V872 HydrophobicContact CD2-CG2 4.11Å; L868-V872 WeakPolarHBondContact O-CG2 3.4Å; L868-V872 PolarHBondContact O-N 3.44Å; V869-V872 PolarHBondContact O-N 2.73Å; R870-V872 PolarHBondContact O-N 3.33Å; V872-E874 VanDerWaalsContact C-N 3.3Å; V872-E874 PolarHBondContact O-N 2.69Å; V872-L875 HydrophobicContact CG1-CD1 4.29Å; V872-L875 WeakPolarHBondContact O-CB 3Å; V872-L875 PolarHBondContact O-N 2.86Å; V872-L888 HydrophobicContact CB-CD1 4.44Å; V872-L888 HydrophobicContact CG1-CD1 3.77Å; V872-L888 HydrophobicContact CG2-CD1 3.69Å; V872-L888 HydrophobicContact CG2-CD2 3.65Å; V872-L888 HydrophobicContact CG2-CG 4.34Å; V872-L907 HydrophobicContact CB-CD1 4.45Å; V872-L907 HydrophobicContact CG1-CD1 4.41Å; V872-L907 HydrophobicContact CG2-CD1 4.15Å; V872-N910 WeakPolarHBondContact CG1-OD1 3.33Å; V872-N910 PolarHBondContact O-OD1 3.32Å; V872-I911 HydrophobicContact CG1-CG1 4.48Å; V872-K914 WeakPolarHBondContact O-CE 3.21Å
873	D	91.9	Very high	91.4	Very high	90 Å²	90	37.9 Å²	37.9	48%	0.481	19%	0.193	S	C	.	.	H	α-helix	trans	-65.1	-34.5	175.3	-161.3	37.4	0	0	0	112.3	V869 R870 N910 K914	V869-D873 WeakPolarHBondContact O-CB 3.33Å; V869-D873 PolarHBondContact O-N 3.25Å; R870-D873 PolarHBondContact O-N 3Å; D873-N910 WeakPolarHBondContact CA-OD1 3.31Å; D873-N910 WeakPolarHBondContact CB-ND2 3.27Å; D873-N910 VanDerWaalsContact CG-ND2 3.29Å; D873-N910 PolarHBondContact N-OD1 3.08Å; D873-N910 PolarHBondContact OD1-ND2 3.36Å; D873-K914 WeakPolarHBondContact O-CE 3.38Å; D873-K914 PolarHBondContact O-NZ 2.87Å
874	E	89.3	Confident	91.5	Very high	49 Å²	49	36 Å²	36	23%	0.229	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	5.8	179.3	-63.5	175.5	-146.8	0	0	112.9	R830 R870 V871 V872	R830-E874 PolarHBondContact NH2-O 3.29Å; R870-E874 IonicContact CZ-OE1 2.75Å; R870-E874 VanDerWaalsContact CZ-OE1 3.29Å; R870-E874 IonicContact NE-OE1 3.62Å; R870-E874 PolarHBondContact NE-OE1 3.05Å; R870-E874 IonicContact NH2-OE1 2.69Å; R870-E874 PolarHBondContact NH2-OE1 2.73Å; R870-E874 WeakPolarHBondContact O-CB 3.47Å; R870-E874 WeakPolarHBondContact O-CG 3.35Å; R870-E874 PolarHBondContact O-N 3.07Å; V871-E874 CarbonylContact O-C 3.58Å; V871-E874 PolarHBondContact O-N 3.15Å; V872-E874 VanDerWaalsContact C-N 3.3Å; V872-E874 PolarHBondContact O-N 2.69Å
875	L	89.6	Confident	91.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.184	C	C	.	.			trans	-66.9	130.5	173.2	-83.2	175.1	0	0	0	112	P835 I839 V871 V872 E879 L880 I884 K914	P835-L875 HydrophobicContact CB-CD2 3.54Å; P835-L875 HydrophobicContact CG-CD2 4.28Å; I839-L875 HydrophobicContact CD1-CD1 4.25Å; V871-L875 WeakPolarHBondContact O-CG 3.44Å; V871-L875 PolarHBondContact O-N 3.07Å; V871-L875 VanDerWaalsContact O-N 3.1Å; V872-L875 HydrophobicContact CG1-CD1 4.29Å; V872-L875 WeakPolarHBondContact O-CB 3Å; V872-L875 PolarHBondContact O-N 2.86Å; L875-E879 HydrophobicContact CD2-CB 4.09Å; L875-L880 HydrophobicContact CD1-CD1 4.05Å; L875-I884 HydrophobicContact CD1-CG2 4.07Å; L875-K914 WeakPolarHBondContact O-CE 3.35Å; L875-K914 PolarHBondContact O-NZ 2.94Å
876	C	84.8	Confident	91.2	Very high	8 Å²	8	39.9 Å²	39.9	5%	0.054	20%	0.2	C	C	.	.			trans	-70.4	151.8	168.7	-73.8	0	0	0	0	111.5	V878 E879 L880 E966 P968	C876-V878 PolarHBondContact O-N 2.87Å; C876-E879 HydrophobicContact CB-CB 4.35Å; C876-E879 HydrophobicContact CB-CG 3.94Å; C876-E879 WeakPolarHBondContact CB-OE2 3.44Å; C876-E879 PolarHBondContact N-OE2 3.21Å; C876-E879 WeakPolarHBondContact O-CB 3.31Å; C876-E879 PolarHBondContact O-N 3Å; C876-L880 PolarHBondContact O-N 3.36Å; C876-E966 VanDerWaalsContact CA-OE2 3.31Å; C876-E966 WeakPolarHBondContact CA-OE2 3.5Å; C876-E966 VanDerWaalsContact CB-OE2 3.28Å; C876-E966 WeakPolarHBondContact CB-OE2 3.45Å; C876-E966 VanDerWaalsContact SG-CB 3.56Å; C876-E966 VanDerWaalsContact SG-CD 3.5Å; C876-E966 PolarHBondContact SG-OE2 3.13Å; C876-P968 VanDerWaalsContact SG-CB 3.54Å; C876-P968 WeakPolarHBondContact SG-CG 3.47Å
877	L	82	Confident	91.1	Very high	28 Å²	28	37 Å²	37	15%	0.147	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.2	-177.2	-60.5	171.1	0	0	0	113.5	K914 Q917 K918 L921	L877-K914 HydrophobicContact CD2-CD 4.1Å; L877-K914 WeakPolarHBondContact CD2-O 3.46Å; L877-Q917 HydrophobicContact CD1-CB 3.84Å; L877-Q917 HydrophobicContact CD2-CB 3.83Å; L877-K918 HydrophobicContact CD2-CB 4.26Å; L877-L921 HydrophobicContact CB-CD1 4.49Å; L877-L921 HydrophobicContact CD1-CD1 3.5Å; L877-L921 VanDerWaalsContact CD1-CD1 3.5Å; L877-L921 HydrophobicContact CD1-CG 4.18Å
878	V	80.5	Confident	91.1	Very high	89 Å²	89	36.8 Å²	36.8	54%	0.539	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-32.9	169.5	-171.1	0	0	0	0	111.5	C876	C876-V878 PolarHBondContact O-N 2.87Å
879	E	86.4	Confident	91	Very high	33 Å²	33	37.3 Å²	37.3	15%	0.154	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-19.7	179	-65	177.4	130.7	0	0	113.2	R830 P835 L875 C876 T881 I884	R830-E879 WeakPolarHBondContact CD-OE1 3.4Å; R830-E879 IonicContact CZ-OE1 3.37Å; R830-E879 IonicContact CZ-OE2 3.76Å; R830-E879 IonicContact NE-OE1 3.49Å; R830-E879 PolarHBondContact NE-OE1 3.14Å; R830-E879 IonicContact NE-OE2 2.72Å; R830-E879 PolarHBondContact NE-OE2 3.12Å; R830-E879 IonicContact NH2-OE1 3.61Å; R830-E879 IonicContact NH2-OE2 3.45Å; R830-E879 PolarHBondContact NH2-OE2 2.92Å; P835-E879 HydrophobicContact CG-CB 4.43Å; P835-E879 HydrophobicContact CG-CG 4.31Å; P835-E879 WeakPolarHBondContact CG-OE1 3.33Å; L875-E879 HydrophobicContact CD2-CB 4.09Å; C876-E879 HydrophobicContact CB-CB 4.35Å; C876-E879 HydrophobicContact CB-CG 3.94Å; C876-E879 WeakPolarHBondContact CB-OE2 3.44Å; C876-E879 PolarHBondContact N-OE2 3.21Å; C876-E879 WeakPolarHBondContact O-CB 3.31Å; C876-E879 PolarHBondContact O-N 3Å; E879-T881 VanDerWaalsContact C-N 3.26Å; E879-T881 PolarHBondContact O-N 3.37Å; E879-I884 VanDerWaalsContact O-CD1 3.29Å; E879-I884 WeakPolarHBondContact O-CD1 3.38Å
880	L	89.1	Confident	91	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	21%	0.206	C	C	.	.			trans	-71.9	77.8	179.6	-172.6	66	0	0	0	111.2	L875 C876 I884 L885 K914 V915 K918	L875-L880 HydrophobicContact CD1-CD1 4.05Å; C876-L880 PolarHBondContact O-N 3.36Å; L880-I884 HydrophobicContact CD1-CG2 4.23Å; L880-L885 HydrophobicContact CD1-CD1 4.39Å; L880-K914 HydrophobicContact CD2-CB 4.04Å; L880-V915 HydrophobicContact CD2-CG2 4.31Å; L880-K918 HydrophobicContact CD2-CD 4.04Å; L880-K918 PolarHBondContact O-NZ 2.89Å
881	T	90.6	Very high	91	Very high	55 Å²	55	37 Å²	37	34%	0.337	19%	0.193	S	C	.	.			trans	-69.3	158.5	173.4	68.9	0	0	0	0	111.4	E879 D883 I884 L885	E879-T881 VanDerWaalsContact C-N 3.26Å; E879-T881 PolarHBondContact O-N 3.37Å; T881-D883 PolarHBondContact O-N 3.15Å; T881-I884 HydrophobicContact CG2-CD1 4.48Å; T881-I884 PolarHBondContact O-N 3.15Å; T881-I884 WeakPolarHBondContact OG1-CG1 3.34Å; T881-I884 PolarHBondContact OG1-N 3.07Å; T881-I884 VanDerWaalsContact OG1-N 3.07Å; T881-L885 WeakPolarHBondContact O-CB 3.31Å; T881-L885 PolarHBondContact O-N 3.25Å
882	E	90	Very high	91.1	Very high	78 Å²	78	37.1 Å²	37.1	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-67	-24.9	176.2	-50.6	-51.9	139.2	0	0	111.7	L885 K886 K918	E882-L885 PolarHBondContact O-N 3.08Å; E882-K886 WeakPolarHBondContact O-CB 3.23Å; E882-K886 WeakPolarHBondContact O-CD 3.49Å; E882-K886 VanDerWaalsContact O-CG 3.22Å; E882-K886 WeakPolarHBondContact O-CG 3.39Å; E882-K886 PolarHBondContact O-N 3.38Å; E882-K918 IonicContact OE1-NZ 2.8Å; E882-K918 PolarHBondContact OE1-NZ 3.5Å
883	D	91.7	Very high	91.2	Very high	93 Å²	93	38.9 Å²	38.9	50%	0.497	20%	0.201	S	C	.	.	H	α-helix	trans	-78.2	-37	177.1	-58.8	-58.1	0	0	0	112.6	T881 L885 Q887	T881-D883 PolarHBondContact O-N 3.15Å; D883-L885 VanDerWaalsContact C-N 3.32Å; D883-Q887 WeakPolarHBondContact O-CB 3.5Å; D883-Q887 VanDerWaalsContact O-CG 3.24Å; D883-Q887 WeakPolarHBondContact O-CG 3.41Å; D883-Q887 PolarHBondContact O-N 3.04Å; D883-Q887 PolarHBondContact O-NE2 2.72Å
884	I	94.3	Very high	91.3	Very high	6 Å²	6	37 Å²	37	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-46	166	-74.6	165.5	0	0	0	109.3	E836 I839 L875 E879 L880 T881 K886 Q887 L888	E836-I884 HydrophobicContact CB-CD1 3.94Å; E836-I884 HydrophobicContact CB-CG1 3.81Å; E836-I884 HydrophobicContact CG-CD1 4.34Å; E836-I884 HydrophobicContact CG-CG1 3.66Å; I839-I884 HydrophobicContact CD1-CG2 3.93Å; L875-I884 HydrophobicContact CD1-CG2 4.07Å; E879-I884 VanDerWaalsContact O-CD1 3.29Å; E879-I884 WeakPolarHBondContact O-CD1 3.38Å; L880-I884 HydrophobicContact CD1-CG2 4.23Å; T881-I884 HydrophobicContact CG2-CD1 4.48Å; T881-I884 PolarHBondContact O-N 3.15Å; T881-I884 WeakPolarHBondContact OG1-CG1 3.34Å; T881-I884 PolarHBondContact OG1-N 3.07Å; T881-I884 VanDerWaalsContact OG1-N 3.07Å; I884-K886 VanDerWaalsContact C-N 3.35Å; I884-K886 PolarHBondContact O-N 3.34Å; I884-Q887 PolarHBondContact O-N 3.28Å; I884-L888 HydrophobicContact CG2-CD1 3.68Å; I884-L888 HydrophobicContact CG2-CG 4.2Å; I884-L888 WeakPolarHBondContact O-CB 3.48Å; I884-L888 VanDerWaalsContact O-CG 3.29Å; I884-L888 WeakPolarHBondContact O-CG 3.48Å; I884-L888 PolarHBondContact O-N 2.74Å
885	L	93.6	Very high	91.6	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-43.1	-177.2	-170.2	57.1	0	0	0	111.9	L144 L880 T881 E882 D883 L888 M889 I911 V915	L144-L885 HydrophobicContact CD2-CD2 3.47Å; L144-L885 VanDerWaalsContact CD2-CD2 3.47Å; L144-L885 HydrophobicContact CD2-CG 3.84Å; L880-L885 HydrophobicContact CD1-CD1 4.39Å; T881-L885 WeakPolarHBondContact O-CB 3.31Å; T881-L885 PolarHBondContact O-N 3.25Å; E882-L885 PolarHBondContact O-N 3.08Å; D883-L885 VanDerWaalsContact C-N 3.32Å; L885-L888 PolarHBondContact O-N 3.35Å; L885-M889 HydrophobicContact CD1-CE 3.65Å; L885-M889 HydrophobicContact CD1-SD 4.5Å; L885-M889 HydrophobicContact CD2-CE 4.27Å; L885-M889 HydrophobicContact CG-CE 3.71Å; L885-M889 HydrophobicContact CG-SD 4.16Å; L885-M889 WeakPolarHBondContact O-CB 3.37Å; L885-M889 VanDerWaalsContact O-CG 3.24Å; L885-M889 WeakPolarHBondContact O-CG 3.4Å; L885-M889 PolarHBondContact O-N 2.92Å; L885-I911 HydrophobicContact CD1-CG2 3.45Å; L885-I911 VanDerWaalsContact CD1-CG2 3.45Å; L885-V915 HydrophobicContact CD1-CG2 3.75Å; L885-V915 HydrophobicContact CD2-CG2 3.87Å
886	K	92.6	Very high	91.9	Very high	78 Å²	78	34.7 Å²	34.7	34%	0.339	18%	0.182	S	C	.	.	H	α-helix	trans	-61.7	-50	172.1	-74.4	164.4	-175.5	175.4	0	112.3	L144 E882 I884 L888 M889 D890	L144-K886 HydrophobicContact CD1-CG 3.67Å; E882-K886 WeakPolarHBondContact O-CB 3.23Å; E882-K886 WeakPolarHBondContact O-CD 3.49Å; E882-K886 VanDerWaalsContact O-CG 3.22Å; E882-K886 WeakPolarHBondContact O-CG 3.39Å; E882-K886 PolarHBondContact O-N 3.38Å; I884-K886 VanDerWaalsContact C-N 3.35Å; I884-K886 PolarHBondContact O-N 3.34Å; K886-L888 VanDerWaalsContact C-N 3.28Å; K886-L888 PolarHBondContact O-N 2.71Å; K886-M889 PolarHBondContact O-N 3.39Å; K886-M889 VanDerWaalsContact O-N 3.09Å; K886-D890 PolarHBondContact O-N 3.13Å
887	Q	94.1	Very high	92.3	Very high	56 Å²	56	35.6 Å²	35.6	26%	0.262	19%	0.188	S	C	.	.	H	α-helix	trans	-56.9	-40.3	178.5	-75.5	169.9	82.3	0	0	112.4	E836 K840 D883 I884 L891	E836-Q887 PolarHBondContact OE1-NE2 3.36Å; K840-Q887 VanDerWaalsContact CG-OE1 3.27Å; D883-Q887 WeakPolarHBondContact O-CB 3.5Å; D883-Q887 VanDerWaalsContact O-CG 3.24Å; D883-Q887 WeakPolarHBondContact O-CG 3.41Å; D883-Q887 PolarHBondContact O-N 3.04Å; D883-Q887 PolarHBondContact O-NE2 2.72Å; I884-Q887 PolarHBondContact O-N 3.28Å; Q887-L891 PolarHBondContact O-N 3.23Å; Q887-L891 VanDerWaalsContact O-N 3.13Å
888	L	95.7	Very high	92.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-72.3	-33.6	177.2	-66.8	176.2	0	0	0	112.9	I839 L868 V872 I884 L885 K886 V892 L907 I911	I839-L888 HydrophobicContact CD1-CD1 4.47Å; I839-L888 HydrophobicContact CD1-CD2 4.42Å; I839-L888 HydrophobicContact CG2-CD2 3.7Å; I839-L888 HydrophobicContact CG2-CG 4.46Å; L868-L888 HydrophobicContact CD2-CD2 4.24Å; V872-L888 HydrophobicContact CB-CD1 4.44Å; V872-L888 HydrophobicContact CG1-CD1 3.77Å; V872-L888 HydrophobicContact CG2-CD1 3.69Å; V872-L888 HydrophobicContact CG2-CD2 3.65Å; V872-L888 HydrophobicContact CG2-CG 4.34Å; I884-L888 HydrophobicContact CG2-CD1 3.68Å; I884-L888 HydrophobicContact CG2-CG 4.2Å; I884-L888 WeakPolarHBondContact O-CB 3.48Å; I884-L888 VanDerWaalsContact O-CG 3.29Å; I884-L888 WeakPolarHBondContact O-CG 3.48Å; I884-L888 PolarHBondContact O-N 2.74Å; L885-L888 PolarHBondContact O-N 3.35Å; K886-L888 VanDerWaalsContact C-N 3.28Å; K886-L888 PolarHBondContact O-N 2.71Å; L888-V892 WeakPolarHBondContact O-CG2 3.31Å; L888-V892 PolarHBondContact O-N 2.9Å; L888-L907 HydrophobicContact CD2-CD1 4.41Å; L888-I911 HydrophobicContact CB-CD1 3.68Å; L888-I911 HydrophobicContact CB-CG1 4.12Å; L888-I911 HydrophobicContact CD1-CG1 4.35Å
889	M	94.9	Very high	93.2	Very high	11 Å²	11	33.8 Å²	33.8	5%	0.054	18%	0.179	C	C	.	.	H	α-helix	trans	-70.7	-40.2	174.5	-74.1	166.3	175.6	0	0	112.6	D140 M143 L144 L885 K886 L891 V892 F893 I911	D140-M889 HydrophobicContact CB-CE 4.3Å; D140-M889 HydrophobicContact CB-CG 4.26Å; D140-M889 HydrophobicContact CB-SD 3.83Å; M143-M889 HydrophobicContact CE-CE 3.27Å; L144-M889 HydrophobicContact CD1-SD 3.83Å; L144-M889 HydrophobicContact CD2-CE 4.27Å; L144-M889 HydrophobicContact CD2-SD 4.14Å; L144-M889 HydrophobicContact CG-SD 4.06Å; L885-M889 HydrophobicContact CD1-CE 3.65Å; L885-M889 HydrophobicContact CD1-SD 4.5Å; L885-M889 HydrophobicContact CD2-CE 4.27Å; L885-M889 HydrophobicContact CG-CE 3.71Å; L885-M889 HydrophobicContact CG-SD 4.16Å; L885-M889 WeakPolarHBondContact O-CB 3.37Å; L885-M889 VanDerWaalsContact O-CG 3.24Å; L885-M889 WeakPolarHBondContact O-CG 3.4Å; L885-M889 PolarHBondContact O-N 2.92Å; K886-M889 PolarHBondContact O-N 3.39Å; K886-M889 VanDerWaalsContact O-N 3.09Å; M889-L891 VanDerWaalsContact C-N 3.31Å; M889-L891 PolarHBondContact O-N 3.01Å; M889-V892 WeakPolarHBondContact O-CB 3.27Å; M889-V892 PolarHBondContact O-N 2.85Å; M889-V892 VanDerWaalsContact O-N 3.16Å; M889-F893 PolarHBondContact O-N 3.37Å; M889-I911 HydrophobicContact CE-CG2 4.02Å
890	D	94.9	Very high	93.4	Very high	88 Å²	88	34.4 Å²	34.4	47%	0.471	18%	0.182	S	C	.	.	H	α-helix	trans	-66.4	-33.3	174	-81.4	-29.6	0	0	0	111.9	K886 F893 T894	K886-D890 PolarHBondContact O-N 3.13Å; D890-F893 PolarHBondContact O-N 3.16Å; D890-T894 WeakPolarHBondContact O-CB 3.47Å; D890-T894 PolarHBondContact O-N 2.86Å; D890-T894 PolarHBondContact O-OG1 3.1Å
891	L	95.6	Very high	93.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-45.5	168.1	175.1	53.8	0	0	0	111.4	F865 L868 Q887 M889 F893 T894 L895 L907	F865-L891 HydrophobicContact CE2-CD2 4.35Å; L868-L891 HydrophobicContact CD1-CD2 3.8Å; L868-L891 HydrophobicContact CD2-CD2 4.05Å; Q887-L891 PolarHBondContact O-N 3.23Å; Q887-L891 VanDerWaalsContact O-N 3.13Å; M889-L891 VanDerWaalsContact C-N 3.31Å; M889-L891 PolarHBondContact O-N 3.01Å; L891-F893 PolarHBondContact O-N 2.9Å; L891-T894 PolarHBondContact O-N 3.47Å; L891-L895 HydrophobicContact CD1-CD1 4.06Å; L891-L895 HydrophobicContact CD1-CD2 4.45Å; L891-L895 HydrophobicContact CD1-CG 3.96Å; L891-L895 HydrophobicContact CG-CD1 4.09Å; L891-L895 HydrophobicContact CG-CG 4.48Å; L891-L895 WeakPolarHBondContact O-CB 3.45Å; L891-L895 VanDerWaalsContact O-CG 3.23Å; L891-L895 WeakPolarHBondContact O-CG 3.43Å; L891-L895 PolarHBondContact O-N 3.5Å; L891-L907 HydrophobicContact CB-CD2 4.38Å; L891-L907 HydrophobicContact CD2-CD2 3.67Å; L891-L907 HydrophobicContact CG-CD2 3.75Å
892	V	97	Very high	93.7	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-44.7	173.5	167.2	0	0	0	0	111.7	I136 L888 M889 T894 L895 V896 L907 R908 I911	I136-V892 HydrophobicContact CG2-CG1 4.22Å; L888-V892 WeakPolarHBondContact O-CG2 3.31Å; L888-V892 PolarHBondContact O-N 2.9Å; M889-V892 WeakPolarHBondContact O-CB 3.27Å; M889-V892 PolarHBondContact O-N 2.85Å; M889-V892 VanDerWaalsContact O-N 3.16Å; V892-T894 VanDerWaalsContact C-N 3.35Å; V892-T894 PolarHBondContact O-N 3.3Å; V892-L895 PolarHBondContact O-N 3.31Å; V892-V896 VanDerWaalsContact O-CG2 3.31Å; V892-V896 WeakPolarHBondContact O-CG2 3.46Å; V892-V896 PolarHBondContact O-N 3.13Å; V892-L907 HydrophobicContact CG2-CB 4.2Å; V892-L907 HydrophobicContact CG2-CD2 3.87Å; V892-L907 HydrophobicContact CG2-CG 3.84Å; V892-R908 HydrophobicContact CG1-CB 4.03Å; V892-R908 HydrophobicContact CG1-CG 4.47Å; V892-R908 HydrophobicContact CG2-CB 4.11Å; V892-I911 HydrophobicContact CG2-CD1 3.8Å
893	F	96.5	Very high	93.8	Very high	38 Å²	38	31.8 Å²	31.8	17%	0.167	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-45.5	175	171.9	-102.4	0	0	0	111.8	G133 R137 M889 D890 L891 V896 C897	G133-F893 VanDerWaalsContact C-CD2 3.5Å; G133-F893 VanDerWaalsContact O-CD2 3.32Å; G133-F893 WeakPolarHBondContact O-CD2 3.28Å; R137-F893 HydrophobicContact CB-CD2 3.75Å; R137-F893 HydrophobicContact CB-CE2 4.27Å; R137-F893 HydrophobicContact CB-CG 4.41Å; R137-F893 HydrophobicContact CG-CD2 4.37Å; M889-F893 PolarHBondContact O-N 3.37Å; D890-F893 PolarHBondContact O-N 3.16Å; L891-F893 PolarHBondContact O-N 2.9Å; F893-V896 PolarHBondContact O-N 3.39Å; F893-C897 PolarHBondContact O-N 2.96Å; F893-C897 PolarHBondContact O-SG 2.71Å
894	T	94.7	Very high	94	Very high	51 Å²	51	27.3 Å²	27.3	31%	0.313	15%	0.149	S	C	.	.	H	α-helix	trans	-63.8	-46.1	179.4	-59.4	0	0	0	0	111.6	D890 L891 V892 V896 C897 N898	D890-T894 WeakPolarHBondContact O-CB 3.47Å; D890-T894 PolarHBondContact O-N 2.86Å; D890-T894 PolarHBondContact O-OG1 3.1Å; L891-T894 PolarHBondContact O-N 3.47Å; V892-T894 VanDerWaalsContact C-N 3.35Å; V892-T894 PolarHBondContact O-N 3.3Å; T894-V896 VanDerWaalsContact C-N 3.32Å; T894-V896 PolarHBondContact O-N 2.76Å; T894-C897 PolarHBondContact O-N 2.86Å; T894-N898 WeakPolarHBondContact O-CB 3.21Å; T894-N898 VanDerWaalsContact O-CG 3.25Å; T894-N898 PolarHBondContact O-N 3.36Å
895	L	94.7	Very high	94.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-41.6	174.5	-68.9	165	0	0	0	111.9	Y846 F865 L891 V892 N898 G899 E900 L903 A904 L907	Y846-L895 HydrophobicContact CE1-CD2 3.8Å; Y846-L895 WeakPolarHBondContact OH-CD2 3.5Å; F865-L895 HydrophobicContact CE2-CD1 3.62Å; F865-L895 HydrophobicContact CE2-CD2 4.26Å; F865-L895 HydrophobicContact CZ-CD1 3.63Å; L891-L895 HydrophobicContact CD1-CD1 4.06Å; L891-L895 HydrophobicContact CD1-CD2 4.45Å; L891-L895 HydrophobicContact CD1-CG 3.96Å; L891-L895 HydrophobicContact CG-CD1 4.09Å; L891-L895 HydrophobicContact CG-CG 4.48Å; L891-L895 WeakPolarHBondContact O-CB 3.45Å; L891-L895 VanDerWaalsContact O-CG 3.23Å; L891-L895 WeakPolarHBondContact O-CG 3.43Å; L891-L895 PolarHBondContact O-N 3.5Å; V892-L895 PolarHBondContact O-N 3.31Å; L895-N898 PolarHBondContact O-N 3.3Å; L895-G899 PolarHBondContact O-N 3.4Å; L895-E900 HydrophobicContact CB-CB 4.46Å; L895-E900 HydrophobicContact CD2-CB 4.09Å; L895-E900 PolarHBondContact O-N 2.93Å; L895-L903 HydrophobicContact CD1-CB 4.42Å; L895-L903 HydrophobicContact CD2-CB 4.2Å; L895-L903 HydrophobicContact CD2-CD1 4.42Å; L895-A904 HydrophobicContact CB-CB 3.77Å; L895-A904 HydrophobicContact CD1-CB 4.48Å; L895-L907 HydrophobicContact CD1-CD2 4.2Å
896	V	95.5	Very high	94.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-45.4	176.8	172.4	0	0	0	0	111.3	L102 Y129 L132 I136 V892 F893 T894 N898 G899 L901 A904	L102-V896 HydrophobicContact CD1-CG2 4.29Å; Y129-V896 WeakPolarHBondContact CB-O 3.31Å; L132-V896 HydrophobicContact CB-CG1 4.09Å; L132-V896 HydrophobicContact CD2-CG1 4.12Å; L132-V896 HydrophobicContact CG-CG1 3.86Å; I136-V896 HydrophobicContact CD1-CG1 4.3Å; I136-V896 HydrophobicContact CD1-CG2 3.85Å; V892-V896 VanDerWaalsContact O-CG2 3.31Å; V892-V896 WeakPolarHBondContact O-CG2 3.46Å; V892-V896 PolarHBondContact O-N 3.13Å; F893-V896 PolarHBondContact O-N 3.39Å; T894-V896 VanDerWaalsContact C-N 3.32Å; T894-V896 PolarHBondContact O-N 2.76Å; V896-N898 VanDerWaalsContact C-N 3.33Å; V896-N898 PolarHBondContact O-N 2.94Å; V896-G899 PolarHBondContact O-N 2.92Å; V896-L901 HydrophobicContact CB-CD2 4.33Å; V896-L901 HydrophobicContact CG1-CD2 3.99Å; V896-L901 HydrophobicContact CG2-CD2 4.33Å; V896-A904 HydrophobicContact CG2-CB 3.57Å
897	C	93.9	Very high	94.4	Very high	28 Å²	28	30 Å²	30	19%	0.189	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-35.3	179	-63.4	0	0	0	0	112.5	Q130 F893 T894 G899	Q130-C897 PolarHBondContact NE2-SG 3.29Å; Q130-C897 VanDerWaalsContact NE2-SG 3.41Å; F893-C897 PolarHBondContact O-N 2.96Å; F893-C897 PolarHBondContact O-SG 2.71Å; T894-C897 PolarHBondContact O-N 2.86Å; C897-G899 PolarHBondContact O-N 2.7Å
898	N	90.4	Very high	94.5	Very high	61 Å²	61	27.5 Å²	27.5	33%	0.326	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10	173.1	-69.7	-11.1	0	0	0	113.6	H851 T894 L895 V896 E900	H851-N898 PolarHBondContact CE1-ND2 3Å; H851-N898 PolarHBondContact NE2-ND2 2.91Å; H851-N898 PolarHBondContact NE2-OD1 3.38Å; T894-N898 WeakPolarHBondContact O-CB 3.21Å; T894-N898 VanDerWaalsContact O-CG 3.25Å; T894-N898 PolarHBondContact O-N 3.36Å; L895-N898 PolarHBondContact O-N 3.3Å; V896-N898 VanDerWaalsContact C-N 3.33Å; V896-N898 PolarHBondContact O-N 2.94Å; N898-E900 HydrophobicContact CB-CG 4.44Å
899	G	90.1	Very high	94.5	Very high	17 Å²	17	33.5 Å²	33.5	18%	0.175	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	8.3	-178.1	0	0	0	0	0	115.4	Y129 L895 V896 C897 L901	Y129-G899 VanDerWaalsContact CE1-CA 3.48Å; L895-G899 PolarHBondContact O-N 3.4Å; V896-G899 PolarHBondContact O-N 2.92Å; C897-G899 PolarHBondContact O-N 2.7Å; G899-L901 PolarHBondContact O-N 3.46Å
900	E	91.2	Very high	94.4	Very high	46 Å²	46	33.7 Å²	33.7	22%	0.215	18%	0.178	C	C	.	.			trans	-81.2	46.6	178.8	-61	-164.3	-109.9	0	0	111.6	Y846 L895 N898 S902 L903 A904	Y846-E900 PolarHBondContact OH-OE1 2.86Å; Y846-E900 PolarHBondContact OH-OE2 3.01Å; Y846-E900 VanDerWaalsContact OH-OE2 3.11Å; L895-E900 HydrophobicContact CB-CB 4.46Å; L895-E900 HydrophobicContact CD2-CB 4.09Å; L895-E900 PolarHBondContact O-N 2.93Å; N898-E900 HydrophobicContact CB-CG 4.44Å; E900-S902 PolarHBondContact O-N 3.28Å; E900-L903 HydrophobicContact CB-CB 4.41Å; E900-L903 HydrophobicContact CB-CD1 4.42Å; E900-L903 PolarHBondContact O-N 2.77Å; E900-L903 WeakPolarHBondContact OE2-CD1 3.28Å; E900-A904 PolarHBondContact O-N 3.47Å
901	L	92.9	Very high	94.4	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-53.8	-33.1	-171.9	-56.8	-170.6	0	0	0	113.2	L102 I105 L106 V109 Y129 L132 V896 G899 R905	L102-L901 HydrophobicContact CD1-CB 4.07Å; L102-L901 HydrophobicContact CD1-CD2 3.87Å; L102-L901 HydrophobicContact CD1-CG 4.36Å; I105-L901 HydrophobicContact CG2-CD1 4.22Å; L106-L901 HydrophobicContact CD1-CB 3.52Å; L106-L901 HydrophobicContact CD1-CD1 4.39Å; V109-L901 HydrophobicContact CB-CD1 4.41Å; Y129-L901 HydrophobicContact CD1-CD1 4.38Å; Y129-L901 HydrophobicContact CD1-CD2 4.06Å; Y129-L901 HydrophobicContact CD1-CG 4.39Å; Y129-L901 HydrophobicContact CE1-CD1 3.97Å; Y129-L901 HydrophobicContact CE1-CD2 4.19Å; Y129-L901 HydrophobicContact CE1-CG 4.02Å; L132-L901 HydrophobicContact CD2-CD2 4.2Å; V896-L901 HydrophobicContact CB-CD2 4.33Å; V896-L901 HydrophobicContact CG1-CD2 3.99Å; V896-L901 HydrophobicContact CG2-CD2 4.33Å; G899-L901 PolarHBondContact O-N 3.46Å; L901-R905 VanDerWaalsContact O-CB 3.25Å; L901-R905 WeakPolarHBondContact O-CB 3.37Å; L901-R905 PolarHBondContact O-N 2.9Å
902	S	92.6	Very high	94.3	Very high	56 Å²	56	31 Å²	31	39%	0.392	16%	0.163	S	C	.	.	H	α-helix	trans	-65.1	-39.5	175.7	-62.5	0	0	0	0	113.1	Q110 E900 V906	Q110-S902 PolarHBondContact NE2-OG 2.81Å; E900-S902 PolarHBondContact O-N 3.28Å; S902-V906 WeakPolarHBondContact O-CG2 3.49Å; S902-V906 PolarHBondContact O-N 3.5Å
903	L	93.8	Very high	94.1	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.12	18%	0.177	C	C	.	.	H	α-helix	trans	-75.9	-45.2	177.6	-62.4	-171.1	0	0	0	110.4	Y846 F865 L895 E900 R905 V906 L907	Y846-L903 HydrophobicContact CE2-CD1 4.33Å; F865-L903 HydrophobicContact CD1-CB 4.2Å; F865-L903 HydrophobicContact CD1-CD1 4.07Å; F865-L903 HydrophobicContact CD1-CD2 3.86Å; F865-L903 HydrophobicContact CD1-CG 4.26Å; F865-L903 HydrophobicContact CE1-CB 3.63Å; F865-L903 HydrophobicContact CE1-CD1 4.34Å; F865-L903 HydrophobicContact CE1-CD2 3.98Å; F865-L903 HydrophobicContact CE1-CG 4.18Å; F865-L903 HydrophobicContact CG-CD1 4.24Å; F865-L903 HydrophobicContact CZ-CB 3.89Å; L895-L903 HydrophobicContact CD1-CB 4.42Å; L895-L903 HydrophobicContact CD2-CB 4.2Å; L895-L903 HydrophobicContact CD2-CD1 4.42Å; E900-L903 HydrophobicContact CB-CB 4.41Å; E900-L903 HydrophobicContact CB-CD1 4.42Å; E900-L903 PolarHBondContact O-N 2.77Å; E900-L903 WeakPolarHBondContact OE2-CD1 3.28Å; L903-R905 VanDerWaalsContact C-N 3.29Å; L903-R905 PolarHBondContact O-N 2.91Å; L903-V906 PolarHBondContact O-N 3.24Å; L903-V906 VanDerWaalsContact O-N 3.12Å; L903-L907 PolarHBondContact O-N 3.02Å
904	A	96	Very high	93.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-52.7	-46	174.1	0	0	0	0	0	111.9	L895 V896 E900 V906 R908	L895-A904 HydrophobicContact CB-CB 3.77Å; L895-A904 HydrophobicContact CD1-CB 4.48Å; V896-A904 HydrophobicContact CG2-CB 3.57Å; E900-A904 PolarHBondContact O-N 3.47Å; A904-V906 PolarHBondContact O-N 3.39Å; A904-R908 WeakPolarHBondContact O-CA 3.5Å; A904-R908 WeakPolarHBondContact O-CB 3.17Å; A904-R908 PolarHBondContact O-N 3.11Å
905	R	95.5	Very high	93.6	Very high	91 Å²	91	30.8 Å²	30.8	34%	0.343	16%	0.162	S	C	.	.	H	α-helix	trans	-62.9	-38.8	179.1	-174	-170	65.8	88.7	9.5	113	L102 E103 L901 L903 K909	L102-R905 HydrophobicContact CD2-CB 4.01Å; L102-R905 HydrophobicContact CG-CB 4.49Å; E103-R905 HydrophobicContact CG-CG 4.19Å; E103-R905 IonicContact OE1-NH1 2.8Å; L901-R905 VanDerWaalsContact O-CB 3.25Å; L901-R905 WeakPolarHBondContact O-CB 3.37Å; L901-R905 PolarHBondContact O-N 2.9Å; L903-R905 VanDerWaalsContact C-N 3.29Å; L903-R905 PolarHBondContact O-N 2.91Å; R905-K909 WeakPolarHBondContact O-CB 3.35Å; R905-K909 PolarHBondContact O-N 3.45Å
906	V	95.9	Very high	93.3	Very high	54 Å²	54	37.4 Å²	37.4	33%	0.327	19%	0.192	S	C	.	.	H	α-helix	trans	-68.7	-52.1	179.8	169.5	0	0	0	0	110.5	V869 S902 L903 A904 K909 N910	V869-V906 HydrophobicContact CG1-CG1 3.88Å; V869-V906 HydrophobicContact CG2-CG1 4.23Å; S902-V906 WeakPolarHBondContact O-CG2 3.49Å; S902-V906 PolarHBondContact O-N 3.5Å; L903-V906 PolarHBondContact O-N 3.24Å; L903-V906 VanDerWaalsContact O-N 3.12Å; A904-V906 PolarHBondContact O-N 3.39Å; V906-K909 PolarHBondContact O-N 3.05Å; V906-N910 PolarHBondContact O-N 3.14Å
907	L	96.8	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-44.2	178.6	177.1	60.7	0	0	0	111.6	F865 L868 V869 V872 L888 L891 V892 L895 L903 K909 N910 I911	F865-L907 HydrophobicContact CE2-CD2 4.14Å; F865-L907 HydrophobicContact CZ-CB 3.85Å; F865-L907 HydrophobicContact CZ-CD2 4.02Å; L868-L907 HydrophobicContact CD2-CD1 4.01Å; L868-L907 HydrophobicContact CD2-CD2 4.3Å; V869-L907 HydrophobicContact CG2-CB 4.33Å; V869-L907 HydrophobicContact CG2-CD1 4.43Å; V872-L907 HydrophobicContact CB-CD1 4.45Å; V872-L907 HydrophobicContact CG1-CD1 4.41Å; V872-L907 HydrophobicContact CG2-CD1 4.15Å; L888-L907 HydrophobicContact CD2-CD1 4.41Å; L891-L907 HydrophobicContact CB-CD2 4.38Å; L891-L907 HydrophobicContact CD2-CD2 3.67Å; L891-L907 HydrophobicContact CG-CD2 3.75Å; V892-L907 HydrophobicContact CG2-CB 4.2Å; V892-L907 HydrophobicContact CG2-CD2 3.87Å; V892-L907 HydrophobicContact CG2-CG 3.84Å; L895-L907 HydrophobicContact CD1-CD2 4.2Å; L903-L907 PolarHBondContact O-N 3.02Å; L907-K909 VanDerWaalsContact C-N 3.33Å; L907-K909 PolarHBondContact O-N 2.79Å; L907-N910 PolarHBondContact O-N 3.13Å; L907-N910 VanDerWaalsContact O-N 3.15Å; L907-I911 HydrophobicContact CD1-CD1 4.23Å; L907-I911 HydrophobicContact CD1-CG1 4.36Å; L907-I911 HydrophobicContact CG-CD1 3.95Å; L907-I911 WeakPolarHBondContact O-CG1 3.4Å; L907-I911 PolarHBondContact O-N 3.19Å
908	R	96.1	Very high	92.4	Very high	5 Å²	5	41.4 Å²	41.4	2%	0.019	21%	0.208	C	C	.	.	H	α-helix	trans	-57.5	-42.9	175.8	-179.9	170.5	-172.3	71.6	6.1	112.6	P95 S99 D140 V892 A904 N910 L912	P95-R908 PolarHBondContact O-NH2 3.37Å; S99-R908 WeakPolarHBondContact OG-CD 3.11Å; S99-R908 PolarHBondContact OG-NE 2.97Å; D140-R908 IonicContact OD1-CZ 3.78Å; D140-R908 IonicContact OD1-NH1 3.61Å; D140-R908 PolarHBondContact OD1-NH1 3.19Å; D140-R908 IonicContact OD1-NH2 3.24Å; D140-R908 PolarHBondContact OD1-NH2 2.98Å; D140-R908 IonicContact OD2-CZ 2.74Å; D140-R908 IonicContact OD2-NH1 3.86Å; D140-R908 PolarHBondContact OD2-NH1 3.32Å; D140-R908 IonicContact OD2-NH2 2.81Å; V892-R908 HydrophobicContact CG1-CB 4.03Å; V892-R908 HydrophobicContact CG1-CG 4.47Å; V892-R908 HydrophobicContact CG2-CB 4.11Å; A904-R908 WeakPolarHBondContact O-CA 3.5Å; A904-R908 WeakPolarHBondContact O-CB 3.17Å; A904-R908 PolarHBondContact O-N 3.11Å; R908-N910 VanDerWaalsContact C-N 3.34Å; R908-L912 HydrophobicContact CG-CD1 4.05Å; R908-L912 HydrophobicContact CG-CG 4.43Å; R908-L912 WeakPolarHBondContact O-CG 3.47Å; R908-L912 PolarHBondContact O-N 3.31Å; R908-L912 VanDerWaalsContact O-N 3.13Å
909	K	95	Very high	92	Very high	126 Å²	126	42.8 Å²	42.8	55%	0.548	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-51.9	175.8	174.3	175.8	168.5	179	0	109.7	R905 V906 L907 I911 L912 D913	R905-K909 WeakPolarHBondContact O-CB 3.35Å; R905-K909 PolarHBondContact O-N 3.45Å; V906-K909 PolarHBondContact O-N 3.05Å; L907-K909 VanDerWaalsContact C-N 3.33Å; L907-K909 PolarHBondContact O-N 2.79Å; K909-I911 VanDerWaalsContact C-N 3.33Å; K909-I911 PolarHBondContact O-N 2.76Å; K909-L912 PolarHBondContact O-N 3.35Å; K909-L912 VanDerWaalsContact O-N 3.08Å; K909-D913 WeakPolarHBondContact CE-OD2 3.43Å; K909-D913 IonicContact NZ-OD2 3.39Å; K909-D913 PolarHBondContact O-N 3.3Å
910	N	94.5	Very high	91.7	Very high	16 Å²	16	47 Å²	47	9%	0.086	23%	0.229	C	C	.	.	H	α-helix	trans	-58.9	-44.7	-175.3	-158.5	-82.5	0	0	0	112.5	V872 D873 V906 L907 R908 L912 D913 K914	V872-N910 WeakPolarHBondContact CG1-OD1 3.33Å; V872-N910 PolarHBondContact O-OD1 3.32Å; D873-N910 WeakPolarHBondContact CA-OD1 3.31Å; D873-N910 WeakPolarHBondContact CB-ND2 3.27Å; D873-N910 VanDerWaalsContact CG-ND2 3.29Å; D873-N910 PolarHBondContact N-OD1 3.08Å; D873-N910 PolarHBondContact OD1-ND2 3.36Å; V906-N910 PolarHBondContact O-N 3.14Å; L907-N910 PolarHBondContact O-N 3.13Å; L907-N910 VanDerWaalsContact O-N 3.15Å; R908-N910 VanDerWaalsContact C-N 3.34Å; N910-L912 VanDerWaalsContact C-N 3.35Å; N910-L912 PolarHBondContact O-N 3.08Å; N910-D913 PolarHBondContact O-N 3.23Å; N910-K914 WeakPolarHBondContact O-CB 3.41Å; N910-K914 WeakPolarHBondContact O-CG 3.47Å; N910-K914 PolarHBondContact O-N 3.03Å
911	I	94.4	Very high	90.9	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-55.4	-47.5	173.9	-65.1	163.5	0	0	0	111.6	V872 L885 L888 M889 V892 L907 K909 K914 V915	V872-I911 HydrophobicContact CG1-CG1 4.48Å; L885-I911 HydrophobicContact CD1-CG2 3.45Å; L885-I911 VanDerWaalsContact CD1-CG2 3.45Å; L888-I911 HydrophobicContact CB-CD1 3.68Å; L888-I911 HydrophobicContact CB-CG1 4.12Å; L888-I911 HydrophobicContact CD1-CG1 4.35Å; M889-I911 HydrophobicContact CE-CG2 4.02Å; V892-I911 HydrophobicContact CG2-CD1 3.8Å; L907-I911 HydrophobicContact CD1-CD1 4.23Å; L907-I911 HydrophobicContact CD1-CG1 4.36Å; L907-I911 HydrophobicContact CG-CD1 3.95Å; L907-I911 WeakPolarHBondContact O-CG1 3.4Å; L907-I911 PolarHBondContact O-N 3.19Å; K909-I911 VanDerWaalsContact C-N 3.33Å; K909-I911 PolarHBondContact O-N 2.76Å; I911-K914 PolarHBondContact O-N 2.7Å; I911-V915 VanDerWaalsContact O-CG2 3.31Å; I911-V915 WeakPolarHBondContact O-CG2 3.14Å; I911-V915 PolarHBondContact O-N 3.08Å
912	L	93.3	Very high	90.2	Very high	27 Å²	27	56.1 Å²	56.1	14%	0.141	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-41.9	-177.7	-67.3	177.9	0	0	0	112.2	P95 S99 M143 R908 K909 N910 K914 V915 E916	P95-L912 HydrophobicContact CB-CD1 4.46Å; P95-L912 HydrophobicContact CB-CD2 3.6Å; S99-L912 VanDerWaalsContact OG-CD1 3.23Å; S99-L912 WeakPolarHBondContact OG-CD1 3.3Å; M143-L912 HydrophobicContact CE-CD2 3.85Å; M143-L912 HydrophobicContact SD-CD2 3.99Å; R908-L912 HydrophobicContact CG-CD1 4.05Å; R908-L912 HydrophobicContact CG-CG 4.43Å; R908-L912 WeakPolarHBondContact O-CG 3.47Å; R908-L912 PolarHBondContact O-N 3.31Å; R908-L912 VanDerWaalsContact O-N 3.13Å; K909-L912 PolarHBondContact O-N 3.35Å; K909-L912 VanDerWaalsContact O-N 3.08Å; N910-L912 VanDerWaalsContact C-N 3.35Å; N910-L912 PolarHBondContact O-N 3.08Å; L912-K914 VanDerWaalsContact C-N 3.34Å; L912-K914 PolarHBondContact O-N 3.42Å; L912-V915 PolarHBondContact O-N 2.88Å; L912-E916 WeakPolarHBondContact O-CB 3.46Å; L912-E916 PolarHBondContact O-N 3.41Å
913	D	92.4	Very high	89.4	Confident	56 Å²	56	60.4 Å²	60.4	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-45.1	175.5	-67.1	6.3	0	0	0	110.5	K909 N910 E916 Q917	K909-D913 WeakPolarHBondContact CE-OD2 3.43Å; K909-D913 IonicContact NZ-OD2 3.39Å; K909-D913 PolarHBondContact O-N 3.3Å; N910-D913 PolarHBondContact O-N 3.23Å; D913-E916 PolarHBondContact O-N 3.29Å; D913-Q917 VanDerWaalsContact O-CG 3.28Å; D913-Q917 WeakPolarHBondContact O-CG 3.33Å; D913-Q917 PolarHBondContact O-N 2.73Å
914	K	90.6	Very high	88.3	Confident	15 Å²	15	62.5 Å²	62.5	7%	0.065	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-39.2	175.6	-72.2	-75.8	-179.2	179.8	0	113.1	V872 D873 L875 L877 L880 N910 I911 L912 Q917 K918	V872-K914 WeakPolarHBondContact O-CE 3.21Å; D873-K914 WeakPolarHBondContact O-CE 3.38Å; D873-K914 PolarHBondContact O-NZ 2.87Å; L875-K914 WeakPolarHBondContact O-CE 3.35Å; L875-K914 PolarHBondContact O-NZ 2.94Å; L877-K914 HydrophobicContact CD2-CD 4.1Å; L877-K914 WeakPolarHBondContact CD2-O 3.46Å; L880-K914 HydrophobicContact CD2-CB 4.04Å; N910-K914 WeakPolarHBondContact O-CB 3.41Å; N910-K914 WeakPolarHBondContact O-CG 3.47Å; N910-K914 PolarHBondContact O-N 3.03Å; I911-K914 PolarHBondContact O-N 2.7Å; L912-K914 VanDerWaalsContact C-N 3.34Å; L912-K914 PolarHBondContact O-N 3.42Å; K914-Q917 PolarHBondContact O-N 3.34Å; K914-K918 WeakPolarHBondContact O-CB 3.47Å; K914-K918 PolarHBondContact O-N 2.73Å
915	V	89.3	Confident	87	Confident	14 Å²	14	67 Å²	67	9%	0.085	31%	0.313	C	S	.	.	H	α-helix	trans	-67.6	-36.6	175.5	170	0	0	0	0	111.6	M143 L880 L885 I911 L912 K918 K919	M143-V915 HydrophobicContact CE-CB 4.4Å; M143-V915 HydrophobicContact CE-CG1 4.04Å; M143-V915 HydrophobicContact CE-CG2 4.16Å; M143-V915 HydrophobicContact SD-CG1 3.74Å; L880-V915 HydrophobicContact CD2-CG2 4.31Å; L885-V915 HydrophobicContact CD1-CG2 3.75Å; L885-V915 HydrophobicContact CD2-CG2 3.87Å; I911-V915 VanDerWaalsContact O-CG2 3.31Å; I911-V915 WeakPolarHBondContact O-CG2 3.14Å; I911-V915 PolarHBondContact O-N 3.08Å; L912-V915 PolarHBondContact O-N 2.88Å; V915-K918 PolarHBondContact O-N 3.01Å; V915-K919 HydrophobicContact CG1-CD 4.3Å; V915-K919 WeakPolarHBondContact O-CG 3.48Å; V915-K919 PolarHBondContact O-N 3.5Å
916	E	88.4	Confident	85.7	Confident	139 Å²	139	67.7 Å²	67.7	65%	0.65	33%	0.331	S	S	*	.	H	α-helix	trans	-65.1	-43.7	173.9	-174.1	163.2	-135.6	0	0	111.4	L912 D913 K918 K919 L920	L912-E916 WeakPolarHBondContact O-CB 3.46Å; L912-E916 PolarHBondContact O-N 3.41Å; D913-E916 PolarHBondContact O-N 3.29Å; E916-K918 PolarHBondContact O-N 3.19Å; E916-K919 WeakPolarHBondContact O-CB 3.48Å; E916-K919 PolarHBondContact O-N 3.38Å; E916-L920 WeakPolarHBondContact O-CB 3.32Å; E916-L920 PolarHBondContact O-N 2.85Å
917	Q	86.4	Confident	84.1	Confident	84 Å²	84	69.7 Å²	69.7	39%	0.393	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-46.9	172.7	-68.7	166.3	11.3	0	0	112.3	L877 D913 K914 K919 L920 L921	L877-Q917 HydrophobicContact CD1-CB 3.84Å; L877-Q917 HydrophobicContact CD2-CB 3.83Å; D913-Q917 VanDerWaalsContact O-CG 3.28Å; D913-Q917 WeakPolarHBondContact O-CG 3.33Å; D913-Q917 PolarHBondContact O-N 2.73Å; K914-Q917 PolarHBondContact O-N 3.34Å; Q917-K919 VanDerWaalsContact C-N 3.29Å; Q917-K919 PolarHBondContact O-N 2.84Å; Q917-L920 PolarHBondContact O-N 3.39Å; Q917-L920 VanDerWaalsContact O-N 3.16Å; Q917-L921 PolarHBondContact O-N 3.4Å
918	K	84.8	Confident	82.1	Confident	29 Å²	29	76.4 Å²	76.4	13%	0.126	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-34.5	176.7	-171.8	174.4	170.2	-168.6	0	112.2	L877 L880 E882 K914 V915 E916 R922	L877-K918 HydrophobicContact CD2-CB 4.26Å; L880-K918 HydrophobicContact CD2-CD 4.04Å; L880-K918 PolarHBondContact O-NZ 2.89Å; E882-K918 IonicContact OE1-NZ 2.8Å; E882-K918 PolarHBondContact OE1-NZ 3.5Å; K914-K918 WeakPolarHBondContact O-CB 3.47Å; K914-K918 PolarHBondContact O-N 2.73Å; V915-K918 PolarHBondContact O-N 3.01Å; E916-K918 PolarHBondContact O-N 3.19Å; K918-R922 WeakPolarHBondContact O-CG 3.34Å; K918-R922 PolarHBondContact O-N 3.37Å
919	K	83	Confident	80	Confident	90 Å²	90	81.7 Å²	81.7	39%	0.391	40%	0.404	S	S	.	.	H	α-helix	trans	-70.4	-44	172.2	-74.5	173	-179.9	179.6	0	112	V915 E916 Q917 R922 Y923	V915-K919 HydrophobicContact CG1-CD 4.3Å; V915-K919 WeakPolarHBondContact O-CG 3.48Å; V915-K919 PolarHBondContact O-N 3.5Å; E916-K919 WeakPolarHBondContact O-CB 3.48Å; E916-K919 PolarHBondContact O-N 3.38Å; Q917-K919 VanDerWaalsContact C-N 3.29Å; Q917-K919 PolarHBondContact O-N 2.84Å; K919-R922 PolarHBondContact O-N 3.01Å; K919-Y923 PolarHBondContact O-N 2.88Å
920	L	82.1	Confident	78	Confident	105 Å²	105	83.9 Å²	83.9	55%	0.55	42%	0.421	S	S	.	.	H	α-helix	trans	-63.1	-43.2	-179.3	-175.1	60.8	0	0	0	111.9	E916 Q917 R922 Y923 T924	E916-L920 WeakPolarHBondContact O-CB 3.32Å; E916-L920 PolarHBondContact O-N 2.85Å; Q917-L920 PolarHBondContact O-N 3.39Å; Q917-L920 VanDerWaalsContact O-N 3.16Å; L920-R922 VanDerWaalsContact C-N 3.34Å; L920-R922 PolarHBondContact O-N 2.93Å; L920-Y923 WeakPolarHBondContact O-CB 3.38Å; L920-Y923 PolarHBondContact O-N 3.05Å; L920-Y923 VanDerWaalsContact O-N 3.12Å; L920-T924 PolarHBondContact O-N 3.45Å; L920-T924 PolarHBondContact O-OG1 3.22Å
921	L	75.9	Confident	76	Confident	76 Å²	76	87.6 Å²	87.6	40%	0.398	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-36.9	174.5	-73.6	-170.2	0	0	0	113.2	L877 Q917 Y923 T924 N925	L877-L921 HydrophobicContact CB-CD1 4.49Å; L877-L921 HydrophobicContact CD1-CD1 3.5Å; L877-L921 VanDerWaalsContact CD1-CD1 3.5Å; L877-L921 HydrophobicContact CD1-CG 4.18Å; Q917-L921 PolarHBondContact O-N 3.4Å; L921-Y923 VanDerWaalsContact C-N 3.31Å; L921-T924 WeakPolarHBondContact CA-OG1 3.38Å; L921-T924 PolarHBondContact O-OG1 2.96Å; L921-N925 VanDerWaalsContact O-CB 3.3Å; L921-N925 WeakPolarHBondContact O-CB 3.25Å; L921-N925 PolarHBondContact O-N 2.96Å; L921-N925 PolarHBondContact O-ND2 3.14Å; L921-N925 VanDerWaalsContact O-ND2 3.17Å
922	R	76.9	Confident	73.6	Confident	166 Å²	166	91.6 Å²	91.6	63%	0.626	49%	0.488	S	S	*	.	H	α-helix	trans	-64.7	-37.8	173.1	-74.5	177.1	175.3	-177.3	-0.1	111.3	K918 K919 L920 S926	K918-R922 WeakPolarHBondContact O-CG 3.34Å; K918-R922 PolarHBondContact O-N 3.37Å; K919-R922 PolarHBondContact O-N 3.01Å; L920-R922 VanDerWaalsContact C-N 3.34Å; L920-R922 PolarHBondContact O-N 2.93Å; R922-S926 VanDerWaalsContact O-CB 3.28Å; R922-S926 WeakPolarHBondContact O-CB 3.38Å; R922-S926 PolarHBondContact O-N 3.5Å
923	Y	76.1	Confident	71.5	Confident	146 Å²	146	101.6 Å²	101.6	57%	0.573	52%	0.524	S	S	*	.	H	α-helix	trans	-68.4	-47.1	176.6	-174.1	-120.4	0	0	0	112.5	K919 L920 L921 S926 L927	K919-Y923 PolarHBondContact O-N 2.88Å; L920-Y923 WeakPolarHBondContact O-CB 3.38Å; L920-Y923 PolarHBondContact O-N 3.05Å; L920-Y923 VanDerWaalsContact O-N 3.12Å; L921-Y923 VanDerWaalsContact C-N 3.31Å; Y923-S926 CarbonylContact O-C 3.58Å; Y923-S926 PolarHBondContact O-N 3.44Å; Y923-L927 HydrophobicContact CD1-CD1 3.94Å; Y923-L927 HydrophobicContact CD2-CD1 4.48Å; Y923-L927 HydrophobicContact CD2-CG 4.43Å; Y923-L927 HydrophobicContact CE1-CD1 3.39Å; Y923-L927 HydrophobicContact CE1-CG 4.31Å; Y923-L927 HydrophobicContact CE2-CD1 3.99Å; Y923-L927 HydrophobicContact CE2-CG 4.07Å; Y923-L927 HydrophobicContact CG-CD1 4.46Å; Y923-L927 VanDerWaalsContact CZ-CD1 3.42Å; Y923-L927 VanDerWaalsContact O-CB 3.31Å; Y923-L927 WeakPolarHBondContact O-CB 3.41Å; Y923-L927 PolarHBondContact O-N 2.67Å
924	T	71.3	Confident	69.3	Low	68 Å²	68	101.6 Å²	101.6	42%	0.417	54%	0.537	S	S	.	.	H	α-helix	trans	-64.8	-40.7	178.1	55.4	0	0	0	0	112.3	L920 L921 S926 L927 K928	L920-T924 PolarHBondContact O-N 3.45Å; L920-T924 PolarHBondContact O-OG1 3.22Å; L921-T924 WeakPolarHBondContact CA-OG1 3.38Å; L921-T924 PolarHBondContact O-OG1 2.96Å; T924-S926 PolarHBondContact O-N 3.46Å; T924-L927 PolarHBondContact O-N 2.72Å; T924-L927 VanDerWaalsContact O-N 3.15Å; T924-K928 PolarHBondContact O-N 2.78Å; T924-K928 VanDerWaalsContact O-N 3.11Å
925	N	68.3	Low	67.3	Low	94 Å²	94	108 Å²	108	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-66.7	-34.6	175.1	-77.9	-40.2	0	0	0	112.8	L921 L927 K928	L921-N925 VanDerWaalsContact O-CB 3.3Å; L921-N925 WeakPolarHBondContact O-CB 3.25Å; L921-N925 PolarHBondContact O-N 2.96Å; L921-N925 PolarHBondContact O-ND2 3.14Å; L921-N925 VanDerWaalsContact O-ND2 3.17Å; N925-L927 VanDerWaalsContact C-N 3.32Å; N925-K928 VanDerWaalsContact OD1-CE 3.31Å; N925-K928 WeakPolarHBondContact OD1-CE 3.22Å
926	S	67.7	Low	65.4	Low	105 Å²	105	110.4 Å²	110.4	73%	0.734	59%	0.594	S	S	*	*	H	α-helix	trans	-75.1	-18.6	171.8	-174.5	0	0	0	0	113.7	R922 Y923 T924	R922-S926 VanDerWaalsContact O-CB 3.28Å; R922-S926 WeakPolarHBondContact O-CB 3.38Å; R922-S926 PolarHBondContact O-N 3.5Å; Y923-S926 CarbonylContact O-C 3.58Å; Y923-S926 PolarHBondContact O-N 3.44Å; T924-S926 PolarHBondContact O-N 3.46Å
927	L	62.4	Low	63.5	Low	96 Å²	96	108.3 Å²	108.3	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-93.3	-7.5	178.2	-93.1	-173.8	0	0	0	114	Y923 T924 N925 P929	Y923-L927 HydrophobicContact CD1-CD1 3.94Å; Y923-L927 HydrophobicContact CD2-CD1 4.48Å; Y923-L927 HydrophobicContact CD2-CG 4.43Å; Y923-L927 HydrophobicContact CE1-CD1 3.39Å; Y923-L927 HydrophobicContact CE1-CG 4.31Å; Y923-L927 HydrophobicContact CE2-CD1 3.99Å; Y923-L927 HydrophobicContact CE2-CG 4.07Å; Y923-L927 HydrophobicContact CG-CD1 4.46Å; Y923-L927 VanDerWaalsContact CZ-CD1 3.42Å; Y923-L927 VanDerWaalsContact O-CB 3.31Å; Y923-L927 WeakPolarHBondContact O-CB 3.41Å; Y923-L927 PolarHBondContact O-N 2.67Å; T924-L927 PolarHBondContact O-N 2.72Å; T924-L927 VanDerWaalsContact O-N 3.15Å; N925-L927 VanDerWaalsContact C-N 3.32Å; L927-P929 WeakPolarHBondContact O-CD 3.4Å
928	K	54.4	Low	62.2	Low	142 Å²	142	109.6 Å²	109.6	62%	0.617	60%	0.602	S	S	*	*			trans	-45.1	111.8	172.2	-77.7	-174.9	176.9	-177.4	0	108	T924 N925 L930	T924-K928 PolarHBondContact O-N 2.78Å; T924-K928 VanDerWaalsContact O-N 3.11Å; N925-K928 VanDerWaalsContact OD1-CE 3.31Å; N925-K928 WeakPolarHBondContact OD1-CE 3.22Å; K928-L930 PolarHBondContact O-N 3.47Å
929	P	53.7	Low	61	Low	116 Å²	116	110.5 Å²	110.5	75%	0.753	61%	0.611	S	S	*	*			trans	-56.6	135.7	178.8	-24.4	34.5	0	0	0	107.6	L927 A931	L927-P929 WeakPolarHBondContact O-CD 3.4Å; P929-A931 PolarHBondContact O-N 2.82Å
930	L	51.3	Low	60.4	Low	171 Å²	171	107.6 Å²	107.6	90%	0.895	61%	0.606	S	S	*	*			trans	-51.6	119.6	159.8	-78.5	173.3	0	0	0	105.6	K928 A932	K928-L930 PolarHBondContact O-N 3.47Å; L930-A932 PolarHBondContact O-N 3.17Å
931	A	53.2	Low	60.7	Low	94 Å²	94	106 Å²	106	78%	0.777	60%	0.601	S	S	*	*			trans	-69.6	74.2	-178.4	0	0	0	0	0	109.1	P929 R933	P929-A931 PolarHBondContact O-N 2.82Å; A931-R933 VanDerWaalsContact C-N 3.29Å; A931-R933 PolarHBondContact O-N 3.21Å
932	A	43.8	Very low	61.5	Low	90 Å²	90	102.6 Å²	102.6	74%	0.744	58%	0.583	S	S	*	*			trans	-50	107.4	149.8	0	0	0	0	0	104.8	L930 G934	L930-A932 PolarHBondContact O-N 3.17Å; A932-G934 PolarHBondContact O-N 3.27Å
933	R	50.3	Low	62.3	Low	238 Å²	238	99 Å²	99	90%	0.898	57%	0.574	S	S	*	*			trans	-62.7	77.6	167.2	-79.1	176.9	160.9	162.4	-6.3	107	A931 V935	A931-R933 VanDerWaalsContact C-N 3.29Å; A931-R933 PolarHBondContact O-N 3.21Å; R933-V935 PolarHBondContact O-N 3.46Å
934	G	46.2	Very low	63.1	Low	56 Å²	56	96.8 Å²	96.8	58%	0.577	57%	0.572	S	S	*	*			trans	-58.2	123.2	175	0	0	0	0	0	106.1	A932 S936	A932-G934 PolarHBondContact O-N 3.27Å; G934-S936 PolarHBondContact O-N 3.46Å
935	V	48.5	Very low	64.3	Low	148 Å²	148	94.7 Å²	94.7	90%	0.897	56%	0.557	S	S	*	*			trans	-72.9	72.9	169.3	-175.4	0	0	0	0	106.3	R933 A937	R933-V935 PolarHBondContact O-N 3.46Å; V935-A937 PolarHBondContact O-N 3.12Å
936	S	48	Very low	65.7	Low	65 Å²	65	97.1 Å²	97.1	46%	0.455	56%	0.559	S	S	.	*			trans	-63.7	117.6	172.3	-171.9	0	0	0	0	106.5	G934 R938	G934-S936 PolarHBondContact O-N 3.46Å; S936-R938 VanDerWaalsContact C-N 3.29Å; S936-R938 PolarHBondContact O-N 2.95Å
937	A	49.3	Very low	67.2	Low	96 Å²	96	92.9 Å²	92.9	79%	0.793	53%	0.529	S	S	*	.			trans	-66	97.1	169.7	0	0	0	0	0	106.7	V935	V935-A937 PolarHBondContact O-N 3.12Å
938	R	59	Low	68.9	Low	110 Å²	110	91.5 Å²	91.5	42%	0.415	52%	0.52	S	S	.	.			trans	-46.5	122.1	-165.4	-83.4	-171.8	169.3	-171.4	-4.2	111.7	S936 G940 D1153	S936-R938 VanDerWaalsContact C-N 3.29Å; S936-R938 PolarHBondContact O-N 2.95Å; R938-G940 VanDerWaalsContact C-N 3.29Å; R938-G940 PolarHBondContact O-N 3Å; R938-D1153 IonicContact CZ-OD2 3.82Å; R938-D1153 IonicContact NE-OD2 3.88Å; R938-D1153 VanDerWaalsContact NH2-CG 3.26Å; R938-D1153 IonicContact NH2-OD2 3.29Å; R938-D1153 PolarHBondContact NH2-OD2 3.41Å
939	P	59.1	Low	71	Confident	48 Å²	48	86.8 Å²	86.8	31%	0.312	50%	0.5	S	S	.	.			trans	-72.6	87.9	172.6	29.8	-32.7	0	0	0	109.3
940	G	71.2	Confident	73.1	Confident	29 Å²	29	81.3 Å²	81.3	30%	0.299	47%	0.465	S	S	.	.			trans	84.9	-177.3	170	0	0	0	0	0	116.8	R938 D944	R938-G940 VanDerWaalsContact C-N 3.29Å; R938-G940 PolarHBondContact O-N 3Å; G940-D944 WeakPolarHBondContact CA-OD2 3.44Å
941	T	87.7	Confident	75.4	Confident	71 Å²	71	73.2 Å²	73.2	44%	0.436	42%	0.422	S	S	.	.			trans	-113.4	166.7	177	90.9	0	0	0	0	111.4	H943 D944	T941-H943 PolarHBondContact O-N 3.01Å; T941-H943 PolarHBondContact OG1-N 3.22Å; T941-H943 VanDerWaalsContact OG1-N 3.14Å; T941-D944 WeakPolarHBondContact CB-OD1 3.41Å; T941-D944 PolarHBondContact N-OD2 2.68Å; T941-D944 WeakPolarHBondContact O-CB 3.43Å; T941-D944 PolarHBondContact O-N 3.33Å; T941-D944 PolarHBondContact OG1-OD1 2.76Å
942	L	92.6	Very high	77.5	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.026	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.3	175.3	-168.2	73.8	0	0	0	113	I950 W998 L1015 K1018 F1019 I1022 F1147	L942-I950 HydrophobicContact CD1-CD1 3.99Å; L942-I950 HydrophobicContact CG-CD1 4.46Å; L942-W998 HydrophobicContact CD1-CH2 4.03Å; L942-L1015 HydrophobicContact CB-CD2 4.2Å; L942-L1015 HydrophobicContact CD2-CD2 3.69Å; L942-K1018 HydrophobicContact CD2-CG 3.75Å; L942-K1018 HydrophobicContact CG-CG 4.03Å; L942-K1018 WeakPolarHBondContact O-CE 3.23Å; L942-K1018 PolarHBondContact O-NZ 3.05Å; L942-F1019 HydrophobicContact CD1-CE1 4.3Å; L942-F1019 HydrophobicContact CD1-CZ 4.23Å; L942-F1019 HydrophobicContact CD2-CD1 4.48Å; L942-F1019 HydrophobicContact CD2-CD2 4.18Å; L942-F1019 HydrophobicContact CD2-CE1 3.85Å; L942-F1019 HydrophobicContact CD2-CE2 3.5Å; L942-F1019 HydrophobicContact CD2-CZ 3.31Å; L942-F1019 HydrophobicContact CG-CZ 4.42Å; L942-I1022 HydrophobicContact CD1-CD1 4.49Å; L942-F1147 HydrophobicContact CB-CZ 3.97Å; L942-F1147 HydrophobicContact CD1-CE1 3.87Å; L942-F1147 HydrophobicContact CD1-CZ 4.03Å
943	H	94	Very high	80.1	Confident	91 Å²	91	66.6 Å²	66.6	42%	0.421	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-17.6	-179.4	-73.9	-70	0	0	0	113.8	T941	T941-H943 PolarHBondContact O-N 3.01Å; T941-H943 PolarHBondContact OG1-N 3.22Å; T941-H943 VanDerWaalsContact OG1-N 3.14Å
944	D	93.6	Very high	82.4	Confident	100 Å²	100	55.4 Å²	55.4	54%	0.535	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-29.6	-171.6	-53	10.3	0	0	0	111.4	G940 T941	G940-D944 WeakPolarHBondContact CA-OD2 3.44Å; T941-D944 WeakPolarHBondContact CB-OD1 3.41Å; T941-D944 PolarHBondContact N-OD2 2.68Å; T941-D944 WeakPolarHBondContact O-CB 3.43Å; T941-D944 PolarHBondContact O-N 3.33Å; T941-D944 PolarHBondContact OG1-OD1 2.76Å
945	F	95.9	Very high	84.9	Confident	24 Å²	24	52.8 Å²	52.8	11%	0.105	29%	0.292	C	S	.	.	S	Bend	trans	-96.9	149.3	178.2	-49.5	-72.9	0	0	0	111.8	I950 K1018 E1143 I1144 F1147	F945-I950 HydrophobicContact CB-CD1 4.12Å; F945-I950 HydrophobicContact CB-CG1 3.93Å; F945-K1018 PolarHBondContact O-NZ 3.46Å; F945-E1143 HydrophobicContact CE1-CB 4.3Å; F945-I1144 HydrophobicContact CB-CD1 4.17Å; F945-I1144 HydrophobicContact CB-CG1 4.26Å; F945-I1144 HydrophobicContact CD1-CD1 3.96Å; F945-I1144 HydrophobicContact CD1-CG1 3.41Å; F945-I1144 VanDerWaalsContact CD1-CG1 3.41Å; F945-I1144 HydrophobicContact CD2-CG1 4.34Å; F945-I1144 HydrophobicContact CE1-CG1 3.71Å; F945-I1144 HydrophobicContact CG-CD1 4.19Å; F945-I1144 HydrophobicContact CG-CG1 3.75Å; F945-I1144 HydrophobicContact CZ-CG1 4.3Å; F945-F1147 HydrophobicContact CD2-CD1 4.23Å; F945-F1147 HydrophobicContact CD2-CG 4.34Å; F945-F1147 HydrophobicContact CE2-CB 3.79Å; F945-F1147 AromaticContact CE2-CD1 3.93Å; F945-F1147 HydrophobicContact CE2-CD1 3.93Å; F945-F1147 AromaticContact CE2-CD2 3.96Å; F945-F1147 HydrophobicContact CE2-CD2 3.96Å; F945-F1147 AromaticContact CE2-CG 3.6Å; F945-F1147 HydrophobicContact CE2-CG 3.6Å; F945-F1147 HydrophobicContact CZ-CB 4.12Å; F945-F1147 HydrophobicContact CZ-CG 4.4Å
946	R	97.6	Very high	87.3	Confident	145 Å²	145	46.6 Å²	46.6	55%	0.547	25%	0.254	S	S	.	.			trans	-77.9	151	-179.9	-54.9	172.7	-71.4	171.9	-0.4	111	H948 E949 I950	R946-H948 VanDerWaalsContact C-N 3.26Å; R946-H948 PolarHBondContact O-N 3.48Å; R946-E949 WeakPolarHBondContact CA-OE2 3.5Å; R946-E949 HydrophobicContact CB-CG 4.16Å; R946-E949 WeakPolarHBondContact CB-OE2 3.38Å; R946-E949 VanDerWaalsContact CG-OE2 3.22Å; R946-E949 WeakPolarHBondContact CG-OE2 3.39Å; R946-E949 IonicContact CZ-OE1 2.7Å; R946-E949 IonicContact CZ-OE2 3.36Å; R946-E949 PolarHBondContact N-OE2 3.21Å; R946-E949 IonicContact NE-OE1 3.6Å; R946-E949 PolarHBondContact NE-OE1 3.5Å; R946-E949 IonicContact NE-OE2 3.23Å; R946-E949 PolarHBondContact NE-OE2 2.9Å; R946-E949 IonicContact NH2-OE1 2.67Å; R946-E949 PolarHBondContact NH2-OE1 3.38Å; R946-E949 IonicContact NH2-OE2 2.67Å; R946-E949 PolarHBondContact O-N 2.84Å; R946-E949 VanDerWaalsContact O-N 3.13Å; R946-I950 PolarHBondContact O-N 3.08Å; R946-I950 VanDerWaalsContact O-N 3.14Å
947	S	98.5	Very high	89.7	Confident	16 Å²	16	44.5 Å²	44.5	11%	0.112	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-20.5	-171.4	-64.6	0	0	0	0	115	A951 K1018	S947-A951 PolarHBondContact O-N 3.4Å; S947-K1018 WeakPolarHBondContact OG-CD 3.37Å; S947-K1018 WeakPolarHBondContact OG-CE 3.49Å; S947-K1018 PolarHBondContact OG-NZ 3.3Å
948	H	98.4	Very high	92	Very high	66 Å²	66	40 Å²	40	31%	0.306	20%	0.2	S	C	.	.	H	α-helix	trans	-76.1	-45.6	169.6	59.5	-90.2	0	0	0	111.2	R946 I950 A951 D952	R946-H948 VanDerWaalsContact C-N 3.26Å; R946-H948 PolarHBondContact O-N 3.48Å; H948-I950 VanDerWaalsContact C-N 3.25Å; H948-I950 PolarHBondContact O-N 2.96Å; H948-A951 CarbonylContact O-C 3.25Å; H948-A951 WeakPolarHBondContact O-CA 3.32Å; H948-A951 WeakPolarHBondContact O-CB 3.4Å; H948-A951 PolarHBondContact O-N 3.38Å; H948-D952 PolarHBondContact O-N 3.32Å
949	E	98.2	Very high	93.8	Very high	44 Å²	44	34.9 Å²	34.9	21%	0.206	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-39.4	-179.8	-56.1	173.1	126.1	0	0	111.6	R946 Q953 I1144	R946-E949 WeakPolarHBondContact CA-OE2 3.5Å; R946-E949 HydrophobicContact CB-CG 4.16Å; R946-E949 WeakPolarHBondContact CB-OE2 3.38Å; R946-E949 VanDerWaalsContact CG-OE2 3.22Å; R946-E949 WeakPolarHBondContact CG-OE2 3.39Å; R946-E949 IonicContact CZ-OE1 2.7Å; R946-E949 IonicContact CZ-OE2 3.36Å; R946-E949 PolarHBondContact N-OE2 3.21Å; R946-E949 IonicContact NE-OE1 3.6Å; R946-E949 PolarHBondContact NE-OE1 3.5Å; R946-E949 IonicContact NE-OE2 3.23Å; R946-E949 PolarHBondContact NE-OE2 2.9Å; R946-E949 IonicContact NH2-OE1 2.67Å; R946-E949 PolarHBondContact NH2-OE1 3.38Å; R946-E949 IonicContact NH2-OE2 2.67Å; R946-E949 PolarHBondContact O-N 2.84Å; R946-E949 VanDerWaalsContact O-N 3.13Å; E949-Q953 WeakPolarHBondContact O-CG 3.01Å; E949-Q953 PolarHBondContact O-N 3.39Å; E949-Q953 VanDerWaalsContact O-N 3.09Å; E949-I1144 HydrophobicContact CB-CD1 3.64Å
950	I	98.5	Very high	95.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-49.8	171.6	-62.8	166.6	0	0	0	110.6	L942 F945 R946 H948 D952 Q953 L954 I1022 F1148	L942-I950 HydrophobicContact CD1-CD1 3.99Å; L942-I950 HydrophobicContact CG-CD1 4.46Å; F945-I950 HydrophobicContact CB-CD1 4.12Å; F945-I950 HydrophobicContact CB-CG1 3.93Å; R946-I950 PolarHBondContact O-N 3.08Å; R946-I950 VanDerWaalsContact O-N 3.14Å; H948-I950 VanDerWaalsContact C-N 3.25Å; H948-I950 PolarHBondContact O-N 2.96Å; I950-D952 VanDerWaalsContact C-N 3.31Å; I950-D952 PolarHBondContact O-N 3.35Å; I950-Q953 PolarHBondContact O-N 3.31Å; I950-L954 HydrophobicContact CG2-CD1 4.04Å; I950-L954 HydrophobicContact CG2-CG 4.26Å; I950-L954 WeakPolarHBondContact O-CB 3.34Å; I950-L954 VanDerWaalsContact O-CG 3.29Å; I950-L954 WeakPolarHBondContact O-CG 3.44Å; I950-L954 PolarHBondContact O-N 3.26Å; I950-I1022 HydrophobicContact CB-CD1 4.29Å; I950-I1022 HydrophobicContact CB-CG1 4.29Å; I950-I1022 HydrophobicContact CD1-CD1 3.91Å; I950-I1022 HydrophobicContact CD1-CG1 4.42Å; I950-I1022 HydrophobicContact CG2-CD1 3.79Å; I950-I1022 HydrophobicContact CG2-CG1 4.14Å; I950-I1022 HydrophobicContact CG2-CG2 4.17Å; I950-F1148 HydrophobicContact CG2-CE1 4.11Å; I950-F1148 HydrophobicContact CG2-CZ 4.06Å
951	A	98.8	Very high	96.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-35.2	179.6	0	0	0	0	0	113.1	S947 H948 T955 I1022 H1025 L1026 L1029	S947-A951 PolarHBondContact O-N 3.4Å; H948-A951 CarbonylContact O-C 3.25Å; H948-A951 WeakPolarHBondContact O-CA 3.32Å; H948-A951 WeakPolarHBondContact O-CB 3.4Å; H948-A951 PolarHBondContact O-N 3.38Å; A951-T955 VanDerWaalsContact O-CB 3.31Å; A951-T955 WeakPolarHBondContact O-CB 3.37Å; A951-T955 PolarHBondContact O-N 3.48Å; A951-T955 PolarHBondContact O-OG1 3.11Å; A951-I1022 HydrophobicContact CB-CG2 4.23Å; A951-H1025 HydrophobicContact CB-CB 3.52Å; A951-L1026 HydrophobicContact CB-CD2 3.83Å; A951-L1026 HydrophobicContact CB-CG 3.9Å; A951-L1029 HydrophobicContact CB-CD1 4.03Å
952	D	98.6	Very high	97.2	Very high	39 Å²	39	32.5 Å²	32.5	21%	0.209	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-47.1	174.7	-61.1	-29.9	0	0	0	110.2	H948 I950 T955 L956 L1138	H948-D952 PolarHBondContact O-N 3.32Å; I950-D952 VanDerWaalsContact C-N 3.31Å; I950-D952 PolarHBondContact O-N 3.35Å; D952-T955 PolarHBondContact O-N 3.44Å; D952-L956 WeakPolarHBondContact O-CB 3.33Å; D952-L956 PolarHBondContact O-N 2.95Å; D952-L1138 HydrophobicContact CB-CD2 4.22Å; D952-L1138 WeakPolarHBondContact O-CD1 3.17Å
953	Q	98.4	Very high	97.4	Very high	6 Å²	6	35 Å²	35	3%	0.028	16%	0.163	C	C	.	.	H	α-helix	trans	-71.6	-35.5	179	-62.3	-37.9	-77.7	0	0	113.4	E949 I950 T955 L956 L957 K1139 N1141 I1144 I1145 F1148	E949-Q953 WeakPolarHBondContact O-CG 3.01Å; E949-Q953 PolarHBondContact O-N 3.39Å; E949-Q953 VanDerWaalsContact O-N 3.09Å; I950-Q953 PolarHBondContact O-N 3.31Å; Q953-T955 VanDerWaalsContact C-N 3.32Å; Q953-L956 PolarHBondContact O-N 3.06Å; Q953-L957 WeakPolarHBondContact O-CG 3.41Å; Q953-L957 PolarHBondContact O-N 2.84Å; Q953-K1139 PolarHBondContact NE2-O 3.36Å; Q953-N1141 HydrophobicContact CG-CB 4.32Å; Q953-I1144 HydrophobicContact CB-CG2 3.77Å; Q953-I1144 HydrophobicContact CG-CB 3.83Å; Q953-I1144 HydrophobicContact CG-CD1 4.2Å; Q953-I1144 HydrophobicContact CG-CG2 3.57Å; Q953-I1145 HydrophobicContact CB-CD1 4Å; Q953-I1145 HydrophobicContact CG-CD1 4.41Å; Q953-F1148 HydrophobicContact CB-CE2 3.7Å; Q953-F1148 HydrophobicContact CB-CZ 4.16Å
954	L	98.6	Very high	97.3	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-43.8	171	-71.5	179.7	0	0	0	111.2	I950 L957 D958 M995 I1022 L1026 I1038 F1148 F1151	I950-L954 HydrophobicContact CG2-CD1 4.04Å; I950-L954 HydrophobicContact CG2-CG 4.26Å; I950-L954 WeakPolarHBondContact O-CB 3.34Å; I950-L954 VanDerWaalsContact O-CG 3.29Å; I950-L954 WeakPolarHBondContact O-CG 3.44Å; I950-L954 PolarHBondContact O-N 3.26Å; L954-L957 PolarHBondContact O-N 3.4Å; L954-D958 PolarHBondContact O-N 3.19Å; L954-M995 HydrophobicContact CD2-CE 3.94Å; L954-M995 HydrophobicContact CD2-SD 3.96Å; L954-I1022 HydrophobicContact CD1-CG2 3.95Å; L954-L1026 HydrophobicContact CB-CD2 4.19Å; L954-L1026 HydrophobicContact CD1-CD1 4.27Å; L954-I1038 HydrophobicContact CD1-CD1 4.04Å; L954-F1148 HydrophobicContact CD2-CE1 4.11Å; L954-F1148 HydrophobicContact CD2-CE2 3.9Å; L954-F1148 HydrophobicContact CD2-CZ 3.64Å; L954-F1148 HydrophobicContact CG-CE2 4.34Å; L954-F1148 HydrophobicContact CG-CZ 3.87Å; L954-F1151 HydrophobicContact CD2-CE1 4.11Å; L954-F1151 HydrophobicContact CD2-CE2 4.43Å; L954-F1151 HydrophobicContact CD2-CZ 3.5Å
955	T	98.8	Very high	97.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.8	-34.7	177.9	-55.7	0	0	0	0	112.4	A951 D952 Q953 A959 L1026 L1029 N1031 I1088 Y1136 L1138	A951-T955 VanDerWaalsContact O-CB 3.31Å; A951-T955 WeakPolarHBondContact O-CB 3.37Å; A951-T955 PolarHBondContact O-N 3.48Å; A951-T955 PolarHBondContact O-OG1 3.11Å; D952-T955 PolarHBondContact O-N 3.44Å; Q953-T955 VanDerWaalsContact C-N 3.32Å; T955-A959 WeakPolarHBondContact O-CB 3.2Å; T955-A959 PolarHBondContact O-N 3.06Å; T955-L1026 WeakPolarHBondContact OG1-CD2 3.04Å; T955-L1029 HydrophobicContact CG2-CB 4.44Å; T955-L1029 WeakPolarHBondContact OG1-CD1 3.34Å; T955-N1031 WeakPolarHBondContact CA-ND2 3.2Å; T955-N1031 HydrophobicContact CG2-CB 3.97Å; T955-N1031 WeakPolarHBondContact OG1-CB 3.43Å; T955-N1031 PolarHBondContact OG1-ND2 3Å; T955-N1031 VanDerWaalsContact OG1-ND2 3.1Å; T955-I1088 HydrophobicContact CG2-CD1 4.03Å; T955-Y1136 HydrophobicContact CG2-CD1 3.92Å; T955-Y1136 HydrophobicContact CG2-CD2 4.12Å; T955-Y1136 HydrophobicContact CG2-CE1 3.63Å; T955-Y1136 HydrophobicContact CG2-CE2 3.88Å; T955-Y1136 HydrophobicContact CG2-CG 4.15Å; T955-L1138 HydrophobicContact CG2-CD1 3.87Å
956	L	98.2	Very high	97.1	Very high	18 Å²	18	32 Å²	32	9%	0.094	15%	0.145	C	C	.	.	H	α-helix	trans	-63.7	-42.3	173.1	-176.2	148.4	0	0	0	111.7	D952 Q953 E960 L1138 R1140	D952-L956 WeakPolarHBondContact O-CB 3.33Å; D952-L956 PolarHBondContact O-N 2.95Å; Q953-L956 PolarHBondContact O-N 3.06Å; L956-E960 HydrophobicContact CD2-CG 4.49Å; L956-E960 VanDerWaalsContact CD2-OE1 3.26Å; L956-E960 WeakPolarHBondContact CD2-OE1 3.47Å; L956-E960 WeakPolarHBondContact O-CB 3.46Å; L956-E960 WeakPolarHBondContact O-CG 3.42Å; L956-E960 PolarHBondContact O-N 2.94Å; L956-L1138 HydrophobicContact CD1-CB 4.3Å; L956-R1140 HydrophobicContact CD1-CB 3.9Å; L956-R1140 HydrophobicContact CD1-CG 4.3Å; L956-R1140 HydrophobicContact CD2-CG 4.2Å
957	L	97.9	Very high	96.8	Very high	22 Å²	22	26.2 Å²	26.2	12%	0.115	13%	0.125	C	C	.	.	H	α-helix	trans	-70.1	-46.2	176.9	-71.7	175.4	0	0	0	113.1	Q953 L954 A959 E960 L961 I1145 F1148 F1151	Q953-L957 WeakPolarHBondContact O-CG 3.41Å; Q953-L957 PolarHBondContact O-N 2.84Å; L954-L957 PolarHBondContact O-N 3.4Å; L957-A959 VanDerWaalsContact C-N 3.27Å; L957-A959 PolarHBondContact O-N 3.46Å; L957-E960 PolarHBondContact O-N 2.85Å; L957-L961 PolarHBondContact O-N 3.46Å; L957-I1145 HydrophobicContact CD1-CD1 3.82Å; L957-I1145 HydrophobicContact CD2-CD1 4.06Å; L957-I1145 HydrophobicContact CG-CD1 3.84Å; L957-F1148 HydrophobicContact CD1-CD2 3.71Å; L957-F1148 HydrophobicContact CD1-CE2 4.13Å; L957-F1151 HydrophobicContact CD1-CE2 4.15Å; L957-F1151 HydrophobicContact CD1-CZ 4.49Å
958	D	98.4	Very high	96.4	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.1	-42.4	173.2	-86.8	-31.8	0	0	0	110.9	L954 L961 F962 H991 N1031 N1033 S1034 I1088	L954-D958 PolarHBondContact O-N 3.19Å; D958-L961 PolarHBondContact O-N 2.9Å; D958-F962 VanDerWaalsContact O-CB 3.3Å; D958-F962 WeakPolarHBondContact O-CB 3.22Å; D958-F962 PolarHBondContact O-N 3.34Å; D958-H991 IonicContact OD1-CD2 3.21Å; D958-N1031 PolarHBondContact OD2-ND2 2.88Å; D958-N1031 PolarHBondContact OD2-OD1 3.13Å; D958-N1031 VanDerWaalsContact OD2-OD1 3.13Å; D958-N1033 PolarHBondContact OD1-ND2 3.04Å; D958-S1034 VanDerWaalsContact OD2-CB 3.25Å; D958-S1034 WeakPolarHBondContact OD2-CB 3.43Å; D958-S1034 PolarHBondContact OD2-N 3.1Å; D958-S1034 PolarHBondContact OD2-OG 2.92Å; D958-I1088 HydrophobicContact CB-CD1 3.43Å; D958-I1088 VanDerWaalsContact CB-CD1 3.43Å; D958-I1088 HydrophobicContact CB-CG2 4.46Å
959	A	97.8	Very high	96.1	Very high	4 Å²	4	23.1 Å²	23.1	3%	0.033	11%	0.11	C	C	.	.	H	α-helix	trans	-67.5	-44.6	179.8	0	0	0	0	0	112.2	T955 L957 L961 F962 Y963 I1088 Y1136	T955-A959 WeakPolarHBondContact O-CB 3.2Å; T955-A959 PolarHBondContact O-N 3.06Å; L957-A959 VanDerWaalsContact C-N 3.27Å; L957-A959 PolarHBondContact O-N 3.46Å; A959-L961 PolarHBondContact O-N 2.83Å; A959-L961 VanDerWaalsContact O-N 3.1Å; A959-F962 PolarHBondContact O-N 3.16Å; A959-Y963 HydrophobicContact CB-CD2 4.26Å; A959-Y963 HydrophobicContact CB-CE2 3.68Å; A959-Y963 WeakPolarHBondContact O-CD2 3.47Å; A959-Y963 PolarHBondContact O-N 3.43Å; A959-Y963 VanDerWaalsContact O-N 3.09Å; A959-I1088 HydrophobicContact CB-CD1 3.98Å; A959-Y1136 HydrophobicContact CB-CD2 3.84Å; A959-Y1136 HydrophobicContact CB-CE2 4.43Å
960	E	95.6	Very high	95.9	Very high	83 Å²	83	21 Å²	21	39%	0.388	10%	0.1	S	C	.	.	H	α-helix	trans	-55.4	-26.5	174.2	-83.6	-177.8	-163.9	0	0	112.2	L956 L957 K964 R1140	L956-E960 HydrophobicContact CD2-CG 4.49Å; L956-E960 VanDerWaalsContact CD2-OE1 3.26Å; L956-E960 WeakPolarHBondContact CD2-OE1 3.47Å; L956-E960 WeakPolarHBondContact O-CB 3.46Å; L956-E960 WeakPolarHBondContact O-CG 3.42Å; L956-E960 PolarHBondContact O-N 2.94Å; L957-E960 PolarHBondContact O-N 2.85Å; E960-K964 PolarHBondContact O-NZ 2.84Å; E960-R1140 IonicContact OE1-NH1 3.51Å; E960-R1140 PolarHBondContact OE1-NH1 3.23Å; E960-R1140 IonicContact OE2-NH1 3.55Å; E960-R1140 PolarHBondContact OE2-NH1 3.15Å
961	L	96.4	Very high	95.6	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-91.6	-47.2	174.5	-64.6	177.9	0	0	0	112.9	L957 D958 A959 Y963 K964 Q987 F988 H991	L957-L961 PolarHBondContact O-N 3.46Å; D958-L961 PolarHBondContact O-N 2.9Å; A959-L961 PolarHBondContact O-N 2.83Å; A959-L961 VanDerWaalsContact O-N 3.1Å; L961-Y963 VanDerWaalsContact C-N 3.28Å; L961-Y963 PolarHBondContact O-N 3.46Å; L961-K964 WeakPolarHBondContact O-CB 3.42Å; L961-K964 PolarHBondContact O-N 3.34Å; L961-Q987 HydrophobicContact CD2-CG 3.87Å; L961-F988 HydrophobicContact CB-CB 4.49Å; L961-F988 HydrophobicContact CB-CD2 3.8Å; L961-H991 HydrophobicContact CD1-CB 3.46Å; L961-H991 VanDerWaalsContact CD1-CB 3.46Å; L961-H991 VanDerWaalsContact CD1-CG 3.47Å
962	F	97.3	Very high	95.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.3	-36.9	-178.5	175.6	-120	0	0	0	113.3	D958 A959 K964 I965 F988 I1088 P1089 L1091 M1128 F1131 Q1132	D958-F962 VanDerWaalsContact O-CB 3.3Å; D958-F962 WeakPolarHBondContact O-CB 3.22Å; D958-F962 PolarHBondContact O-N 3.34Å; A959-F962 PolarHBondContact O-N 3.16Å; F962-K964 PolarHBondContact O-N 2.86Å; F962-I965 HydrophobicContact CD2-CD1 4.37Å; F962-I965 PolarHBondContact O-N 3.46Å; F962-F988 HydrophobicContact CB-CD2 4.33Å; F962-F988 HydrophobicContact CB-CE2 3.81Å; F962-I1088 HydrophobicContact CB-CG2 4.22Å; F962-I1088 HydrophobicContact CD1-CG2 4.38Å; F962-I1088 HydrophobicContact CG-CG2 4.15Å; F962-P1089 HydrophobicContact CE2-CG 3.87Å; F962-P1089 HydrophobicContact CZ-CG 3.85Å; F962-L1091 HydrophobicContact CE2-CD2 4.13Å; F962-M1128 HydrophobicContact CE2-CE 4.26Å; F962-M1128 HydrophobicContact CE2-CG 3.97Å; F962-M1128 HydrophobicContact CZ-CG 4.1Å; F962-F1131 HydrophobicContact CE1-CB 3.98Å; F962-F1131 HydrophobicContact CZ-CB 4.02Å; F962-Q1132 HydrophobicContact CD1-CG 4.29Å; F962-Q1132 HydrophobicContact CE1-CG 3.66Å; F962-Q1132 HydrophobicContact CE2-CG 4.25Å; F962-Q1132 HydrophobicContact CZ-CG 3.63Å; F962-Q1132 PolarHBondContact O-NE2 3.5Å
963	Y	95.1	Very high	94.7	Very high	57 Å²	57	22.3 Å²	22.3	22%	0.224	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.5	177	-57.3	-40.2	0	0	0	114.2	A959 L961 Q1132 V1134 H1135 Y1136	A959-Y963 HydrophobicContact CB-CD2 4.26Å; A959-Y963 HydrophobicContact CB-CE2 3.68Å; A959-Y963 WeakPolarHBondContact O-CD2 3.47Å; A959-Y963 PolarHBondContact O-N 3.43Å; A959-Y963 VanDerWaalsContact O-N 3.09Å; L961-Y963 VanDerWaalsContact C-N 3.28Å; L961-Y963 PolarHBondContact O-N 3.46Å; Y963-Q1132 HydrophobicContact CD1-CG 4.39Å; Y963-V1134 PolarHBondContact OH-O 2.98Å; Y963-H1135 AromaticContact CD2-CD2 3.66Å; Y963-H1135 AromaticContact CD2-NE2 3.83Å; Y963-H1135 HydrophobicContact CE2-CB 4.32Å; Y963-H1135 AromaticContact CE2-CD2 3.59Å; Y963-H1135 AromaticContact CE2-CG 3.98Å; Y963-H1135 AromaticContact CG-NE2 3.92Å; Y963-H1135 WeakPolarHBondContact OH-CA 3.37Å; Y963-Y1136 VanDerWaalsContact OH-CD2 3.25Å; Y963-Y1136 WeakPolarHBondContact OH-CD2 3.4Å; Y963-Y1136 PolarHBondContact OH-N 3.19Å
964	K	92.1	Very high	94.3	Very high	95 Å²	95	22.3 Å²	22.3	41%	0.413	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-18.1	172.9	-59.2	-168.2	-173.2	85.5	0	113.8	E960 L961 F962 E966 N984	E960-K964 PolarHBondContact O-NZ 2.84Å; L961-K964 WeakPolarHBondContact O-CB 3.42Å; L961-K964 PolarHBondContact O-N 3.34Å; F962-K964 PolarHBondContact O-N 2.86Å; K964-E966 PolarHBondContact O-N 3.21Å; K964-N984 HydrophobicContact CB-CB 4.06Å; K964-N984 PolarHBondContact O-ND2 2.95Å
965	I	93.6	Very high	93.7	Very high	3 Å²	3	28 Å²	28	2%	0.015	13%	0.13	C	C	.	.			trans	-73.5	110.7	-173.3	-51.4	174.2	0	0	0	109.3	F962 V970 N984 L985 F988 L1091 M1128 Q1132	F962-I965 HydrophobicContact CD2-CD1 4.37Å; F962-I965 PolarHBondContact O-N 3.46Å; I965-V970 HydrophobicContact CG2-CG2 3.69Å; I965-N984 HydrophobicContact CG1-CB 4.26Å; I965-L985 HydrophobicContact CD1-CD1 4.29Å; I965-L985 HydrophobicContact CG2-CB 4.14Å; I965-L985 HydrophobicContact CG2-CD1 4.31Å; I965-F988 HydrophobicContact CD1-CB 3.75Å; I965-F988 HydrophobicContact CD1-CD1 4.13Å; I965-F988 HydrophobicContact CD1-CD2 4.09Å; I965-F988 HydrophobicContact CD1-CG 3.74Å; I965-F988 HydrophobicContact CG1-CB 4.49Å; I965-L1091 HydrophobicContact CD1-CD1 3.52Å; I965-M1128 HydrophobicContact CB-CE 3.92Å; I965-M1128 HydrophobicContact CG2-CE 3.82Å; I965-Q1132 PolarHBondContact O-NE2 3.36Å
966	E	91.5	Very high	93.1	Very high	55 Å²	55	31.6 Å²	31.6	26%	0.257	15%	0.147	S	C	.	.			trans	-78.8	136.8	177.5	-54	-170	104.4	0	0	109.5	C876 K964 P968 E969	C876-E966 VanDerWaalsContact CA-OE2 3.31Å; C876-E966 WeakPolarHBondContact CA-OE2 3.5Å; C876-E966 VanDerWaalsContact CB-OE2 3.28Å; C876-E966 WeakPolarHBondContact CB-OE2 3.45Å; C876-E966 VanDerWaalsContact SG-CB 3.56Å; C876-E966 VanDerWaalsContact SG-CD 3.5Å; C876-E966 PolarHBondContact SG-OE2 3.13Å; K964-E966 PolarHBondContact O-N 3.21Å; E966-P968 VanDerWaalsContact C-N 3.27Å; E966-P968 VanDerWaalsContact O-N 3.14Å; E966-E969 HydrophobicContact CB-CG 4.31Å; E966-E969 PolarHBondContact N-OE1 2.75Å; E966-E969 VanDerWaalsContact O-CB 3.3Å; E966-E969 WeakPolarHBondContact O-CB 3.27Å; E966-E969 PolarHBondContact O-N 3.3Å
967	I	92.2	Very high	92.6	Very high	22 Å²	22	33.7 Å²	33.7	11%	0.113	16%	0.156	C	C	.	.	H	α-helix	trans	-52.2	-36	-178.3	-60.4	-67.5	0	0	0	113.9	T827 E969 V970 L971 L1125 M1128 R1129	T827-I967 HydrophobicContact CG2-CG2 3.86Å; I967-E969 VanDerWaalsContact C-N 3.32Å; I967-E969 PolarHBondContact O-N 2.99Å; I967-V970 PolarHBondContact O-N 3.48Å; I967-L971 HydrophobicContact CG2-CD1 4.29Å; I967-L971 PolarHBondContact O-N 3.21Å; I967-L971 VanDerWaalsContact O-N 3.13Å; I967-L1125 HydrophobicContact CD1-CD2 4.27Å; I967-L1125 HydrophobicContact CG2-CD1 3.86Å; I967-L1125 HydrophobicContact CG2-CD2 4.13Å; I967-L1125 HydrophobicContact CG2-CG 4.4Å; I967-M1128 HydrophobicContact CD1-CE 3.97Å; I967-M1128 HydrophobicContact CD1-CG 4.08Å; I967-M1128 HydrophobicContact CD1-SD 3.92Å; I967-R1129 HydrophobicContact CD1-CG 3.77Å; I967-R1129 HydrophobicContact CG1-CG 4.08Å
968	P	90.8	Very high	92.1	Very high	12 Å²	12	35.1 Å²	35.1	8%	0.078	16%	0.164	C	C	.	.	H	α-helix	trans	-59.9	-34.4	173.3	-29	40.2	0	0	0	114.7	C876 E966 V970 L971 L972	C876-P968 VanDerWaalsContact SG-CB 3.54Å; C876-P968 WeakPolarHBondContact SG-CG 3.47Å; E966-P968 VanDerWaalsContact C-N 3.27Å; E966-P968 VanDerWaalsContact O-N 3.14Å; P968-V970 VanDerWaalsContact C-N 3.26Å; P968-V970 PolarHBondContact O-N 2.96Å; P968-L971 PolarHBondContact O-N 2.7Å; P968-L972 WeakPolarHBondContact O-CB 3.32Å; P968-L972 WeakPolarHBondContact O-CD1 3.49Å; P968-L972 PolarHBondContact O-N 2.79Å
969	E	91.3	Very high	91.6	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.023	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-41.6	176.8	-61.7	-179.8	-111	0	0	110.8	E966 I967 W973 S982 P983 N984 L985	E966-E969 HydrophobicContact CB-CG 4.31Å; E966-E969 PolarHBondContact N-OE1 2.75Å; E966-E969 VanDerWaalsContact O-CB 3.3Å; E966-E969 WeakPolarHBondContact O-CB 3.27Å; E966-E969 PolarHBondContact O-N 3.3Å; I967-E969 VanDerWaalsContact C-N 3.32Å; I967-E969 PolarHBondContact O-N 2.99Å; E969-W973 VanDerWaalsContact O-CB 3.27Å; E969-W973 WeakPolarHBondContact O-CB 3.48Å; E969-W973 PolarHBondContact O-N 2.69Å; E969-S982 PolarHBondContact O-OG 3.21Å; E969-S982 WeakPolarHBondContact OE2-CA 3.45Å; E969-P983 WeakPolarHBondContact OE2-CD 3.47Å; E969-P983 VanDerWaalsContact OE2-N 3.15Å; E969-N984 WeakPolarHBondContact OE1-CB 3.24Å; E969-N984 PolarHBondContact OE1-ND2 3.03Å; E969-N984 WeakPolarHBondContact OE2-CA 3.27Å; E969-N984 WeakPolarHBondContact OE2-CB 3.16Å; E969-N984 PolarHBondContact OE2-N 3.38Å; E969-L985 HydrophobicContact CB-CB 4.46Å; E969-L985 PolarHBondContact OE2-N 3.49Å; E969-L985 VanDerWaalsContact OE2-N 3.14Å
970	V	93.8	Very high	91	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-69.7	-40.1	-179.4	-168	0	0	0	0	111	I965 I967 P968 A974 L1095 L1098 L1125 M1128	I965-V970 HydrophobicContact CG2-CG2 3.69Å; I967-V970 PolarHBondContact O-N 3.48Å; P968-V970 VanDerWaalsContact C-N 3.26Å; P968-V970 PolarHBondContact O-N 2.96Å; V970-A974 PolarHBondContact O-N 2.91Å; V970-L1095 HydrophobicContact CG1-CD2 3.64Å; V970-L1098 HydrophobicContact CG1-CD1 3.64Å; V970-L1125 HydrophobicContact CB-CD2 4.18Å; V970-L1125 HydrophobicContact CG1-CD2 3.87Å; V970-M1128 HydrophobicContact CG2-CE 3.93Å; V970-M1128 HydrophobicContact CG2-SD 3.99Å
971	L	91.9	Very high	90.4	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-40.9	175.4	-80.6	170.8	0	0	0	113.1	T827 T828 T831 I967 P968 L1098 Q1121 L1125	T827-L971 WeakPolarHBondContact O-CD1 3.35Å; T828-L971 HydrophobicContact CG2-CD1 4.48Å; T831-L971 HydrophobicContact CG2-CD2 4.34Å; I967-L971 HydrophobicContact CG2-CD1 4.29Å; I967-L971 PolarHBondContact O-N 3.21Å; I967-L971 VanDerWaalsContact O-N 3.13Å; P968-L971 PolarHBondContact O-N 2.7Å; L971-L1098 HydrophobicContact CD2-CD2 4.48Å; L971-Q1121 HydrophobicContact CD2-CB 4.18Å; L971-L1125 HydrophobicContact CD1-CD1 4.01Å; L971-L1125 HydrophobicContact CD2-CD1 3.58Å; L971-L1125 HydrophobicContact CG-CD1 3.62Å
972	L	88.2	Confident	90.1	Very high	38 Å²	38	47 Å²	47	20%	0.199	22%	0.217	C	C	.	.	H	α-helix	trans	-70.6	-37.8	177	-91.9	61.3	0	0	0	110.9	P968 A974 K975 E976 K981	P968-L972 WeakPolarHBondContact O-CB 3.32Å; P968-L972 WeakPolarHBondContact O-CD1 3.49Å; P968-L972 PolarHBondContact O-N 2.79Å; L972-A974 VanDerWaalsContact C-N 3.33Å; L972-A974 PolarHBondContact O-N 3.03Å; L972-K975 PolarHBondContact O-N 3.24Å; L972-K975 VanDerWaalsContact O-N 3.1Å; L972-E976 PolarHBondContact O-N 3.42Å; L972-K981 HydrophobicContact CD2-CB 4.29Å; L972-K981 HydrophobicContact CD2-CD 4.19Å
973	W	91.1	Very high	89.7	Confident	25 Å²	25	49.7 Å²	49.7	10%	0.095	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-44.1	175.8	-172	-88.3	0	0	0	112.3	M547 E969 K975 E976 Q977 E979 L985 L1095	M547-W973 HydrophobicContact CE-CH2 4.31Å; M547-W973 HydrophobicContact CE-CZ2 3.96Å; M547-W973 HydrophobicContact SD-CH2 4.32Å; E969-W973 VanDerWaalsContact O-CB 3.27Å; E969-W973 WeakPolarHBondContact O-CB 3.48Å; E969-W973 PolarHBondContact O-N 2.69Å; W973-K975 PolarHBondContact O-N 3.32Å; W973-E976 PolarHBondContact O-N 3.4Å; W973-Q977 HydrophobicContact CD2-CB 4.4Å; W973-Q977 HydrophobicContact CD2-CG 4.47Å; W973-Q977 HydrophobicContact CZ2-CB 4.21Å; W973-Q977 HydrophobicContact CZ2-CG 4.47Å; W973-Q977 WeakPolarHBondContact O-CA 3.41Å; W973-Q977 WeakPolarHBondContact O-CG 3.2Å; W973-Q977 PolarHBondContact O-N 2.82Å; W973-E979 HydrophobicContact CH2-CG 4.24Å; W973-E979 HydrophobicContact CZ3-CG 4.06Å; W973-L985 HydrophobicContact CB-CD2 3.65Å; W973-L985 HydrophobicContact CD2-CD2 3.96Å; W973-L985 HydrophobicContact CE3-CD2 4.31Å; W973-L985 HydrophobicContact CG-CD2 3.67Å; W973-L1095 HydrophobicContact CB-CD2 4.44Å; W973-L1095 HydrophobicContact CG-CD2 4.34Å
974	A	90.1	Very high	89.6	Confident	5 Å²	5	48.4 Å²	48.4	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-8.3	178.3	0	0	0	0	0	115	V970 L972 L1098 H1102	V970-A974 PolarHBondContact O-N 2.91Å; L972-A974 VanDerWaalsContact C-N 3.33Å; L972-A974 PolarHBondContact O-N 3.03Å; A974-L1098 HydrophobicContact CB-CB 3.64Å; A974-H1102 PolarHBondContact O-CD2 3.44Å
975	K	85.8	Confident	89.7	Confident	125 Å²	125	44 Å²	44	54%	0.543	21%	0.213	S	C	.	.	H	α-helix	trans	-112.8	-40.7	176.7	-179.4	-164.3	170.5	-147.9	0	112.8	L972 W973	L972-K975 PolarHBondContact O-N 3.24Å; L972-K975 VanDerWaalsContact O-N 3.1Å; W973-K975 PolarHBondContact O-N 3.32Å
976	E	86.7	Confident	89.7	Confident	75 Å²	75	44.4 Å²	44.4	35%	0.35	22%	0.215	S	C	.	.	H	α-helix	trans	-126.9	-11.2	-164.4	-58.8	-176.1	-168.7	0	0	114.7	L972 W973 N978 K981	L972-E976 PolarHBondContact O-N 3.42Å; W973-E976 PolarHBondContact O-N 3.4Å; E976-N978 HydrophobicContact CB-CB 4.45Å; E976-N978 PolarHBondContact O-N 2.9Å; E976-N978 VanDerWaalsContact O-N 3.08Å; E976-K981 IonicContact OE2-NZ 2.8Å; E976-K981 PolarHBondContact OE2-NZ 2.99Å
977	Q	87.7	Confident	89.8	Confident	62 Å²	62	45.7 Å²	45.7	29%	0.29	22%	0.221	S	C	.	.			trans	41.8	44.1	-179.3	-62.3	-170.8	-11.4	0	0	114.3	Y554 W973	Y554-Q977 PolarHBondContact OH-OE1 3.08Å; W973-Q977 HydrophobicContact CD2-CB 4.4Å; W973-Q977 HydrophobicContact CD2-CG 4.47Å; W973-Q977 HydrophobicContact CZ2-CB 4.21Å; W973-Q977 HydrophobicContact CZ2-CG 4.47Å; W973-Q977 WeakPolarHBondContact O-CA 3.41Å; W973-Q977 WeakPolarHBondContact O-CG 3.2Å; W973-Q977 PolarHBondContact O-N 2.82Å
978	N	86.4	Confident	90	Very high	52 Å²	52	44.6 Å²	44.6	28%	0.278	22%	0.216	S	C	.	.			trans	-105.5	118.1	-171.7	-179.1	-79.9	0	0	0	111.7	E976 E980 K981 S982	E976-N978 HydrophobicContact CB-CB 4.45Å; E976-N978 PolarHBondContact O-N 2.9Å; E976-N978 VanDerWaalsContact O-N 3.08Å; N978-E980 PolarHBondContact OD1-N 3.2Å; N978-E980 VanDerWaalsContact OD1-N 3.17Å; N978-K981 HydrophobicContact CB-CB 4.34Å; N978-K981 HydrophobicContact CB-CD 4.3Å; N978-K981 HydrophobicContact CB-CG 4.46Å; N978-K981 PolarHBondContact O-N 3.32Å; N978-K981 WeakPolarHBondContact OD1-CG 3.39Å; N978-K981 PolarHBondContact OD1-N 2.87Å; N978-S982 WeakPolarHBondContact O-CB 3.38Å; N978-S982 PolarHBondContact O-N 3.43Å; N978-S982 VanDerWaalsContact O-N 3.15Å; N978-S982 PolarHBondContact O-OG 3.39Å
979	E	88.9	Confident	90.3	Very high	97 Å²	97	44.8 Å²	44.8	45%	0.453	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-36.7	-176.4	-59.5	179.3	163	0	0	113.4	W973 K981 S982 T986	W973-E979 HydrophobicContact CH2-CG 4.24Å; W973-E979 HydrophobicContact CZ3-CG 4.06Å; E979-K981 VanDerWaalsContact C-N 3.27Å; E979-K981 PolarHBondContact O-N 3.34Å; E979-S982 CarbonylContact O-C 3.47Å; E979-S982 PolarHBondContact O-N 3.04Å; E979-T986 HydrophobicContact CB-CG2 4.23Å; E979-T986 HydrophobicContact CG-CG2 4.04Å
980	E	85	Confident	90.4	Very high	165 Å²	165	49.5 Å²	49.5	77%	0.771	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.9	178.8	-58.3	-171.6	139.4	0	0	112.5	N978	N978-E980 PolarHBondContact OD1-N 3.2Å; N978-E980 VanDerWaalsContact OD1-N 3.17Å
981	K	82.8	Confident	90.5	Very high	89 Å²	89	50.8 Å²	50.8	39%	0.387	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-13.5	176.1	-66.2	179.5	-168.9	-175.8	0	113.7	L972 E976 N978 E979 P983	L972-K981 HydrophobicContact CD2-CB 4.29Å; L972-K981 HydrophobicContact CD2-CD 4.19Å; E976-K981 IonicContact OE2-NZ 2.8Å; E976-K981 PolarHBondContact OE2-NZ 2.99Å; N978-K981 HydrophobicContact CB-CB 4.34Å; N978-K981 HydrophobicContact CB-CD 4.3Å; N978-K981 HydrophobicContact CB-CG 4.46Å; N978-K981 PolarHBondContact O-N 3.32Å; N978-K981 WeakPolarHBondContact OD1-CG 3.39Å; N978-K981 PolarHBondContact OD1-N 2.87Å; E979-K981 VanDerWaalsContact C-N 3.27Å; E979-K981 PolarHBondContact O-N 3.34Å; K981-P983 VanDerWaalsContact C-CD 3.42Å
982	S	89.6	Confident	90.8	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.007	24%	0.243	C	C	.	.			trans	-130.2	46.1	-175.7	-55.5	0	0	0	0	113	E969 N978 E979 N984 L985 T986	E969-S982 PolarHBondContact O-OG 3.21Å; E969-S982 WeakPolarHBondContact OE2-CA 3.45Å; N978-S982 WeakPolarHBondContact O-CB 3.38Å; N978-S982 PolarHBondContact O-N 3.43Å; N978-S982 VanDerWaalsContact O-N 3.15Å; N978-S982 PolarHBondContact O-OG 3.39Å; E979-S982 CarbonylContact O-C 3.47Å; E979-S982 PolarHBondContact O-N 3.04Å; S982-N984 PolarHBondContact O-N 2.85Å; S982-L985 WeakPolarHBondContact O-CB 3.34Å; S982-L985 PolarHBondContact O-N 3.48Å; S982-T986 PolarHBondContact O-N 2.83Å; S982-T986 PolarHBondContact O-OG1 3.03Å
983	P	89.3	Confident	91.1	Very high	56 Å²	56	49.9 Å²	49.9	36%	0.364	24%	0.24	S	C	.	.	H	α-helix	trans	-69.1	-30.6	-164.2	29.3	-37.6	0	0	0	114.9	E969 K981 Q987	E969-P983 WeakPolarHBondContact OE2-CD 3.47Å; E969-P983 VanDerWaalsContact OE2-N 3.15Å; K981-P983 VanDerWaalsContact C-CD 3.42Å; P983-Q987 WeakPolarHBondContact O-CB 3.33Å; P983-Q987 PolarHBondContact O-N 3.3Å
984	N	92.6	Very high	91.4	Very high	30 Å²	30	51.2 Å²	51.2	16%	0.16	25%	0.249	C	C	.	.	H	α-helix	trans	-77	-36.1	176.4	-54.4	-68.8	0	0	0	110.2	K964 I965 E969 S982 Q987 F988	K964-N984 HydrophobicContact CB-CB 4.06Å; K964-N984 PolarHBondContact O-ND2 2.95Å; I965-N984 HydrophobicContact CG1-CB 4.26Å; E969-N984 WeakPolarHBondContact OE1-CB 3.24Å; E969-N984 PolarHBondContact OE1-ND2 3.03Å; E969-N984 WeakPolarHBondContact OE2-CA 3.27Å; E969-N984 WeakPolarHBondContact OE2-CB 3.16Å; E969-N984 PolarHBondContact OE2-N 3.38Å; S982-N984 PolarHBondContact O-N 2.85Å; N984-Q987 PolarHBondContact O-N 3.27Å; N984-F988 WeakPolarHBondContact O-CB 2.93Å; N984-F988 PolarHBondContact O-N 3.4Å
985	L	94.6	Very high	91.8	Very high	2 Å²	2	51 Å²	51	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-48.6	172	-178.2	62.7	0	0	0	110.8	I965 E969 W973 S982 Q987 F988 T989 L1091 L1095	I965-L985 HydrophobicContact CD1-CD1 4.29Å; I965-L985 HydrophobicContact CG2-CB 4.14Å; I965-L985 HydrophobicContact CG2-CD1 4.31Å; E969-L985 HydrophobicContact CB-CB 4.46Å; E969-L985 PolarHBondContact OE2-N 3.49Å; E969-L985 VanDerWaalsContact OE2-N 3.14Å; W973-L985 HydrophobicContact CB-CD2 3.65Å; W973-L985 HydrophobicContact CD2-CD2 3.96Å; W973-L985 HydrophobicContact CE3-CD2 4.31Å; W973-L985 HydrophobicContact CG-CD2 3.67Å; S982-L985 WeakPolarHBondContact O-CB 3.34Å; S982-L985 PolarHBondContact O-N 3.48Å; L985-Q987 VanDerWaalsContact C-N 3.35Å; L985-Q987 PolarHBondContact O-N 2.99Å; L985-F988 WeakPolarHBondContact O-CB 3.24Å; L985-F988 PolarHBondContact O-N 3.05Å; L985-F988 VanDerWaalsContact O-N 3.13Å; L985-T989 WeakPolarHBondContact O-CG2 3.47Å; L985-T989 PolarHBondContact O-N 3.35Å; L985-T989 PolarHBondContact O-OG1 2.81Å; L985-L1091 HydrophobicContact CD1-CD1 3.78Å; L985-L1095 HydrophobicContact CD1-CD1 4.44Å; L985-L1095 HydrophobicContact CD2-CD1 4.4Å; L985-L1095 HydrophobicContact CD2-CD2 4.11Å
986	T	93.4	Very high	92.3	Very high	12 Å²	12	45 Å²	45	7%	0.074	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-43.3	175.3	-62	0	0	0	0	111.6	E979 S982 F988 T989 E990	E979-T986 HydrophobicContact CB-CG2 4.23Å; E979-T986 HydrophobicContact CG-CG2 4.04Å; S982-T986 PolarHBondContact O-N 2.83Å; S982-T986 PolarHBondContact O-OG1 3.03Å; T986-F988 VanDerWaalsContact C-N 3.27Å; T986-F988 PolarHBondContact O-N 2.98Å; T986-T989 PolarHBondContact O-N 3.42Å; T986-T989 PolarHBondContact O-OG1 3.1Å; T986-T989 VanDerWaalsContact O-OG1 3.05Å; T986-E990 HydrophobicContact CG2-CG 4.32Å; T986-E990 WeakPolarHBondContact O-CB 3.49Å; T986-E990 WeakPolarHBondContact O-CG 3.35Å; T986-E990 PolarHBondContact O-N 3.07Å
987	Q	94.1	Very high	92.8	Very high	81 Å²	81	42.8 Å²	42.8	38%	0.379	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-36	176.1	-171	175.2	36.2	0	0	112.6	L961 P983 N984 L985 H991	L961-Q987 HydrophobicContact CD2-CG 3.87Å; P983-Q987 WeakPolarHBondContact O-CB 3.33Å; P983-Q987 PolarHBondContact O-N 3.3Å; N984-Q987 PolarHBondContact O-N 3.27Å; L985-Q987 VanDerWaalsContact C-N 3.35Å; L985-Q987 PolarHBondContact O-N 2.99Å; Q987-H991 WeakPolarHBondContact O-CB 3.29Å; Q987-H991 PolarHBondContact O-N 2.67Å
988	F	97	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.3	-39.5	177	-176.9	-93.7	0	0	0	112.6	L961 F962 I965 N984 L985 T986 H991 F992 N1033 I1088 L1091	L961-F988 HydrophobicContact CB-CB 4.49Å; L961-F988 HydrophobicContact CB-CD2 3.8Å; F962-F988 HydrophobicContact CB-CD2 4.33Å; F962-F988 HydrophobicContact CB-CE2 3.81Å; I965-F988 HydrophobicContact CD1-CB 3.75Å; I965-F988 HydrophobicContact CD1-CD1 4.13Å; I965-F988 HydrophobicContact CD1-CD2 4.09Å; I965-F988 HydrophobicContact CD1-CG 3.74Å; I965-F988 HydrophobicContact CG1-CB 4.49Å; N984-F988 WeakPolarHBondContact O-CB 2.93Å; N984-F988 PolarHBondContact O-N 3.4Å; L985-F988 WeakPolarHBondContact O-CB 3.24Å; L985-F988 PolarHBondContact O-N 3.05Å; L985-F988 VanDerWaalsContact O-N 3.13Å; T986-F988 VanDerWaalsContact C-N 3.27Å; T986-F988 PolarHBondContact O-N 2.98Å; F988-H991 PolarHBondContact O-N 2.96Å; F988-F992 PolarHBondContact O-N 2.96Å; F988-F992 VanDerWaalsContact O-N 3.14Å; F988-N1033 VanDerWaalsContact CE1-OD1 3.26Å; F988-N1033 WeakPolarHBondContact CE1-OD1 3.27Å; F988-N1033 HydrophobicContact CZ-CB 3.94Å; F988-N1033 VanDerWaalsContact CZ-ND2 3.31Å; F988-N1033 WeakPolarHBondContact CZ-ND2 3.37Å; F988-N1033 WeakPolarHBondContact CZ-OD1 3.36Å; F988-I1088 HydrophobicContact CE2-CG2 4.3Å; F988-I1088 HydrophobicContact CZ-CG2 4.07Å; F988-L1091 HydrophobicContact CD1-CD1 3.7Å; F988-L1091 HydrophobicContact CD1-CG 4.34Å; F988-L1091 HydrophobicContact CE1-CD1 3.62Å; F988-L1091 HydrophobicContact CE1-CG 3.78Å; F988-L1091 HydrophobicContact CZ-CD1 4.36Å; F988-L1091 HydrophobicContact CZ-CG 4.46Å
989	T	95.4	Very high	93.8	Very high	16 Å²	16	37.6 Å²	37.6	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-73.9	-36.8	177.5	62.1	0	0	0	0	112.3	Y545 L985 T986 H991 F992 N993	Y545-T989 HydrophobicContact CD1-CG2 3.31Å; Y545-T989 HydrophobicContact CE1-CG2 3.41Å; Y545-T989 VanDerWaalsContact CE1-CG2 3.41Å; Y545-T989 HydrophobicContact CG-CG2 3.99Å; L985-T989 WeakPolarHBondContact O-CG2 3.47Å; L985-T989 PolarHBondContact O-N 3.35Å; L985-T989 PolarHBondContact O-OG1 2.81Å; T986-T989 PolarHBondContact O-N 3.42Å; T986-T989 PolarHBondContact O-OG1 3.1Å; T986-T989 VanDerWaalsContact O-OG1 3.05Å; T989-H991 VanDerWaalsContact C-N 3.34Å; T989-H991 PolarHBondContact O-N 2.63Å; T989-F992 PolarHBondContact O-N 3.46Å; T989-N993 WeakPolarHBondContact O-CB 3.48Å; T989-N993 PolarHBondContact O-N 3.42Å; T989-N993 PolarHBondContact O-ND2 3Å
990	E	94.7	Very high	94.2	Very high	104 Å²	104	33.4 Å²	33.4	49%	0.486	16%	0.163	S	C	.	.	H	α-helix	trans	-56.9	-45.6	167.3	-76.3	-173.8	151	0	0	111.5	T986 F992 N993 N994	T986-E990 HydrophobicContact CG2-CG 4.32Å; T986-E990 WeakPolarHBondContact O-CB 3.49Å; T986-E990 WeakPolarHBondContact O-CG 3.35Å; T986-E990 PolarHBondContact O-N 3.07Å; E990-F992 PolarHBondContact O-N 2.8Å; E990-N993 PolarHBondContact O-N 2.72Å; E990-N994 WeakPolarHBondContact O-CB 3.42Å; E990-N994 PolarHBondContact O-N 3.4Å; E990-N994 PolarHBondContact O-ND2 2.83Å
991	H	96.4	Very high	94.8	Very high	27 Å²	27	25.6 Å²	25.6	13%	0.125	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-47.3	179.3	-171.1	82.4	0	0	0	112.4	D958 L961 Q987 F988 T989 N993 N994 M995 F1151	D958-H991 IonicContact OD1-CD2 3.21Å; L961-H991 HydrophobicContact CD1-CB 3.46Å; L961-H991 VanDerWaalsContact CD1-CB 3.46Å; L961-H991 VanDerWaalsContact CD1-CG 3.47Å; Q987-H991 WeakPolarHBondContact O-CB 3.29Å; Q987-H991 PolarHBondContact O-N 2.67Å; F988-H991 PolarHBondContact O-N 2.96Å; T989-H991 VanDerWaalsContact C-N 3.34Å; T989-H991 PolarHBondContact O-N 2.63Å; H991-N993 VanDerWaalsContact C-N 3.33Å; H991-N993 PolarHBondContact O-N 2.95Å; H991-N994 PolarHBondContact O-N 3.21Å; H991-M995 WeakPolarHBondContact NE2-CE 3.43Å; H991-M995 VanDerWaalsContact O-CB 3.32Å; H991-M995 WeakPolarHBondContact O-CB 3.32Å; H991-M995 PolarHBondContact O-N 2.75Å; H991-F1151 AromaticContact CE1-CD2 3.8Å; H991-F1151 AromaticContact CE1-CE2 3.56Å; H991-F1151 AromaticContact NE2-CE2 3.82Å
992	F	97.4	Very high	95.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.6	-48.1	174	-179.8	-75.2	0	0	0	111.5	P541 Y545 F988 T989 E990 S996 N1033 L1036 A1037 Y1090	P541-F992 HydrophobicContact CB-CZ 4.28Å; Y545-F992 HydrophobicContact CD2-CB 4.14Å; Y545-F992 AromaticContact CD2-CD1 3.48Å; Y545-F992 HydrophobicContact CD2-CD1 3.48Å; Y545-F992 VanDerWaalsContact CD2-CD1 3.48Å; Y545-F992 HydrophobicContact CD2-CD2 4.08Å; Y545-F992 AromaticContact CD2-CE1 3.8Å; Y545-F992 HydrophobicContact CD2-CE1 3.8Å; Y545-F992 HydrophobicContact CD2-CE2 4.33Å; Y545-F992 AromaticContact CD2-CG 3.64Å; Y545-F992 HydrophobicContact CD2-CG 3.64Å; Y545-F992 HydrophobicContact CD2-CZ 4.19Å; Y545-F992 HydrophobicContact CE2-CB 4.22Å; Y545-F992 AromaticContact CE2-CD1 3.98Å; Y545-F992 HydrophobicContact CE2-CD1 3.98Å; Y545-F992 AromaticContact CE2-CD2 3.69Å; Y545-F992 HydrophobicContact CE2-CD2 3.69Å; Y545-F992 HydrophobicContact CE2-CE1 4.23Å; Y545-F992 AromaticContact CE2-CE2 3.92Å; Y545-F992 HydrophobicContact CE2-CE2 3.92Å; Y545-F992 AromaticContact CE2-CG 3.71Å; Y545-F992 HydrophobicContact CE2-CG 3.71Å; Y545-F992 HydrophobicContact CE2-CZ 4.19Å; F988-F992 PolarHBondContact O-N 2.96Å; F988-F992 VanDerWaalsContact O-N 3.14Å; T989-F992 PolarHBondContact O-N 3.46Å; E990-F992 PolarHBondContact O-N 2.8Å; F992-S996 PolarHBondContact O-N 2.93Å; F992-N1033 WeakPolarHBondContact CD2-OD1 3.07Å; F992-N1033 VanDerWaalsContact CE2-O 3.32Å; F992-N1033 WeakPolarHBondContact CE2-O 3.41Å; F992-L1036 HydrophobicContact CE2-CB 4.02Å; F992-L1036 HydrophobicContact CZ-CB 4.12Å; F992-A1037 HydrophobicContact CD1-CB 4.26Å; F992-A1037 HydrophobicContact CD2-CB 3.73Å; F992-A1037 HydrophobicContact CE1-CB 4.29Å; F992-A1037 HydrophobicContact CE2-CB 3.8Å; F992-A1037 VanDerWaalsContact CE2-N 3.26Å; F992-A1037 HydrophobicContact CG-CB 3.99Å; F992-A1037 HydrophobicContact CZ-CB 4.09Å; F992-Y1090 AromaticContact CE2-CD2 3.88Å; F992-Y1090 HydrophobicContact CE2-CD2 3.88Å; F992-Y1090 AromaticContact CE2-CE2 3.8Å; F992-Y1090 HydrophobicContact CE2-CE2 3.8Å; F992-Y1090 HydrophobicContact CZ-CD2 4.37Å; F992-Y1090 AromaticContact CZ-CE2 3.85Å; F992-Y1090 HydrophobicContact CZ-CE2 3.85Å
993	N	95.4	Very high	95.7	Very high	23 Å²	23	22.1 Å²	22.1	12%	0.123	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-50.4	-178.8	-76.2	-29.7	0	0	0	111.5	Y545 T989 E990 H991 M995 S996 Y997	Y545-N993 PolarHBondContact O-ND2 3.06Å; T989-N993 WeakPolarHBondContact O-CB 3.48Å; T989-N993 PolarHBondContact O-N 3.42Å; T989-N993 PolarHBondContact O-ND2 3Å; E990-N993 PolarHBondContact O-N 2.72Å; H991-N993 VanDerWaalsContact C-N 3.33Å; H991-N993 PolarHBondContact O-N 2.95Å; N993-M995 VanDerWaalsContact C-N 3.33Å; N993-M995 PolarHBondContact O-N 2.91Å; N993-S996 WeakPolarHBondContact O-CB 3.22Å; N993-S996 PolarHBondContact O-N 3.36Å; N993-S996 VanDerWaalsContact O-N 3.11Å; N993-Y997 WeakPolarHBondContact O-CD2 3.29Å; N993-Y997 PolarHBondContact O-N 2.89Å
994	N	96.3	Very high	96.1	Very high	53 Å²	53	19.6 Å²	19.6	28%	0.283	10%	0.096	S	C	.	.	H	α-helix	trans	-60.8	-42.9	-179.4	-66.2	-15.5	0	0	0	111.1	E990 H991 S996 Y997 W998 F1151	E990-N994 WeakPolarHBondContact O-CB 3.42Å; E990-N994 PolarHBondContact O-N 3.4Å; E990-N994 PolarHBondContact O-ND2 2.83Å; H991-N994 PolarHBondContact O-N 3.21Å; N994-S996 PolarHBondContact O-N 3.34Å; N994-Y997 PolarHBondContact O-N 2.66Å; N994-W998 VanDerWaalsContact O-CB 3.27Å; N994-W998 WeakPolarHBondContact O-CB 3.31Å; N994-W998 PolarHBondContact O-N 2.99Å; N994-F1151 HydrophobicContact CB-CB 4.01Å
995	M	97.8	Very high	96.2	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-46.1	173.2	-170.5	-168.6	-55.3	0	0	111.6	L954 H991 N993 W998 V999 S1034 A1037 F1151	L954-M995 HydrophobicContact CD2-CE 3.94Å; L954-M995 HydrophobicContact CD2-SD 3.96Å; H991-M995 WeakPolarHBondContact NE2-CE 3.43Å; H991-M995 VanDerWaalsContact O-CB 3.32Å; H991-M995 WeakPolarHBondContact O-CB 3.32Å; H991-M995 PolarHBondContact O-N 2.75Å; N993-M995 VanDerWaalsContact C-N 3.33Å; N993-M995 PolarHBondContact O-N 2.91Å; M995-W998 PolarHBondContact O-N 3.19Å; M995-V999 WeakPolarHBondContact O-CG2 3.24Å; M995-V999 PolarHBondContact O-N 3.37Å; M995-S1034 WeakPolarHBondContact CE-OG 3.32Å; M995-S1034 PolarHBondContact SD-OG 2.84Å; M995-A1037 HydrophobicContact CB-CB 4.49Å; M995-A1037 HydrophobicContact CG-CB 4.47Å; M995-A1037 HydrophobicContact SD-CB 3.89Å; M995-F1151 HydrophobicContact CB-CD1 4.38Å; M995-F1151 HydrophobicContact CB-CD2 4.26Å; M995-F1151 HydrophobicContact CB-CG 4.21Å; M995-F1151 HydrophobicContact CE-CE2 4.17Å; M995-F1151 HydrophobicContact CE-CZ 4.35Å; M995-F1151 HydrophobicContact CG-CD1 4.27Å; M995-F1151 HydrophobicContact CG-CE1 4.11Å; M995-F1151 HydrophobicContact CG-CE2 4.46Å; M995-F1151 HydrophobicContact CG-CZ 4.23Å
996	S	97.5	Very high	96.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.9	-46.8	177.2	-161.8	0	0	0	0	111.9	F992 N993 N994 W998 V999 R1000 A1037 S1040 A1041	F992-S996 PolarHBondContact O-N 2.93Å; N993-S996 WeakPolarHBondContact O-CB 3.22Å; N993-S996 PolarHBondContact O-N 3.36Å; N993-S996 VanDerWaalsContact O-N 3.11Å; N994-S996 PolarHBondContact O-N 3.34Å; S996-W998 VanDerWaalsContact C-N 3.35Å; S996-W998 PolarHBondContact O-N 3.14Å; S996-V999 PolarHBondContact O-N 3.27Å; S996-R1000 VanDerWaalsContact O-CG 3.24Å; S996-R1000 WeakPolarHBondContact O-CG 3.29Å; S996-R1000 PolarHBondContact O-N 3.02Å; S996-A1037 WeakPolarHBondContact CB-O 3.42Å; S996-A1037 PolarHBondContact OG-O 2.85Å; S996-S1040 PolarHBondContact OG-OG 3.5Å; S996-A1041 WeakPolarHBondContact O-CB 3.46Å; S996-A1041 PolarHBondContact OG-N 3.31Å
997	Y	96.8	Very high	96.2	Very high	27 Å²	27	33.6 Å²	33.6	11%	0.106	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-35.3	176.4	-77.1	-69.8	0	0	0	113.3	Q546 N993 N994 R1000 S1001 H1154 E1157 L1160	Q546-Y997 PolarHBondContact NE2-OH 3.25Å; N993-Y997 WeakPolarHBondContact O-CD2 3.29Å; N993-Y997 PolarHBondContact O-N 2.89Å; N994-Y997 PolarHBondContact O-N 2.66Å; Y997-R1000 VanDerWaalsContact CE1-NH1 3.3Å; Y997-R1000 PolarHBondContact O-N 3.37Å; Y997-S1001 VanDerWaalsContact O-CB 3.32Å; Y997-S1001 WeakPolarHBondContact O-CB 3.37Å; Y997-S1001 PolarHBondContact O-N 2.96Å; Y997-S1001 PolarHBondContact O-OG 3.43Å; Y997-H1154 WeakPolarHBondContact CB-ND1 3.48Å; Y997-E1157 HydrophobicContact CE1-CB 4.11Å; Y997-E1157 HydrophobicContact CE1-CG 4.39Å; Y997-E1157 PolarHBondContact OH-OE2 3.25Å; Y997-E1157 VanDerWaalsContact OH-OE2 3.13Å; Y997-L1160 HydrophobicContact CD1-CD1 3.75Å; Y997-L1160 HydrophobicContact CE1-CD1 4.2Å
998	W	97	Very high	96.2	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-45.2	174.3	177.3	93.4	0	0	0	111.8	L942 N994 M995 S996 R1000 S1001 L1002 F1019 F1147 F1148 F1151 H1154	L942-W998 HydrophobicContact CD1-CH2 4.03Å; N994-W998 VanDerWaalsContact O-CB 3.27Å; N994-W998 WeakPolarHBondContact O-CB 3.31Å; N994-W998 PolarHBondContact O-N 2.99Å; M995-W998 PolarHBondContact O-N 3.19Å; S996-W998 VanDerWaalsContact C-N 3.35Å; S996-W998 PolarHBondContact O-N 3.14Å; W998-R1000 PolarHBondContact O-N 2.76Å; W998-S1001 WeakPolarHBondContact O-CB 3.46Å; W998-S1001 PolarHBondContact O-N 2.7Å; W998-L1002 HydrophobicContact CD2-CD1 3.77Å; W998-L1002 HydrophobicContact CD2-CG 4.34Å; W998-L1002 HydrophobicContact CE3-CD1 3.82Å; W998-L1002 HydrophobicContact CH2-CD1 3.67Å; W998-L1002 HydrophobicContact CZ2-CD1 3.62Å; W998-L1002 HydrophobicContact CZ3-CD1 3.77Å; W998-L1002 WeakPolarHBondContact O-CG 3.01Å; W998-L1002 PolarHBondContact O-N 2.94Å; W998-F1019 HydrophobicContact CZ3-CE1 4.21Å; W998-F1019 HydrophobicContact CZ3-CZ 4.19Å; W998-F1147 AromaticContact CH2-CE1 3.77Å; W998-F1147 HydrophobicContact CH2-CE1 3.77Å; W998-F1147 HydrophobicContact CH2-CZ 4.24Å; W998-F1147 HydrophobicContact CZ2-CD1 4.44Å; W998-F1147 AromaticContact CZ2-CE1 3.72Å; W998-F1147 HydrophobicContact CZ2-CE1 3.72Å; W998-F1147 AromaticContact CZ2-CZ 3.96Å; W998-F1147 HydrophobicContact CZ2-CZ 3.96Å; W998-F1148 AromaticContact CH2-CD1 3.84Å; W998-F1148 HydrophobicContact CH2-CD1 3.84Å; W998-F1148 HydrophobicContact CH2-CE1 4.14Å; W998-F1148 HydrophobicContact CZ2-CD1 4.05Å; W998-F1151 HydrophobicContact CB-CB 4.07Å; W998-F1151 HydrophobicContact CB-CD1 4.06Å; W998-F1151 AromaticContact CD2-CD1 3.59Å; W998-F1151 HydrophobicContact CD2-CD1 3.59Å; W998-F1151 HydrophobicContact CD2-CE1 4.09Å; W998-F1151 AromaticContact CE2-CD1 3.98Å; W998-F1151 AromaticContact CE3-CD1 3.75Å; W998-F1151 HydrophobicContact CE3-CD1 3.75Å; W998-F1151 AromaticContact CE3-CE1 3.88Å; W998-F1151 HydrophobicContact CE3-CE1 3.88Å; W998-F1151 HydrophobicContact CG-CB 4.33Å; W998-F1151 AromaticContact CG-CD1 3.77Å; W998-F1151 HydrophobicContact CG-CD1 3.77Å; W998-F1151 HydrophobicContact CH2-CE1 4.2Å; W998-F1151 HydrophobicContact CZ2-CD1 4.49Å; W998-F1151 HydrophobicContact CZ2-CE1 4.37Å; W998-F1151 HydrophobicContact CZ3-CD1 4.29Å; W998-F1151 AromaticContact CZ3-CE1 3.95Å; W998-F1151 HydrophobicContact CZ3-CE1 3.95Å; W998-H1154 HydrophobicContact CB-CB 4.4Å
999	V	98.1	Very high	96.1	Very high	1 Å²	1	39 Å²	39	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-45.8	172.9	174.5	0	0	0	0	111.2	M995 S996 S1001 L1002 I1003 F1019 I1038 A1041 L1042	M995-V999 WeakPolarHBondContact O-CG2 3.24Å; M995-V999 PolarHBondContact O-N 3.37Å; S996-V999 PolarHBondContact O-N 3.27Å; V999-S1001 VanDerWaalsContact C-N 3.26Å; V999-S1001 PolarHBondContact O-N 3.42Å; V999-L1002 PolarHBondContact O-N 3.31Å; V999-I1003 HydrophobicContact CG1-CD1 4.08Å; V999-I1003 PolarHBondContact O-N 3.5Å; V999-F1019 HydrophobicContact CB-CE1 4.41Å; V999-F1019 HydrophobicContact CB-CZ 4.21Å; V999-F1019 HydrophobicContact CG1-CD1 4.18Å; V999-F1019 HydrophobicContact CG1-CD2 3.88Å; V999-F1019 HydrophobicContact CG1-CE1 4.11Å; V999-F1019 HydrophobicContact CG1-CE2 3.79Å; V999-F1019 HydrophobicContact CG1-CG 4.09Å; V999-F1019 HydrophobicContact CG1-CZ 3.9Å; V999-F1019 HydrophobicContact CG2-CD1 4.18Å; V999-F1019 HydrophobicContact CG2-CE1 3.61Å; V999-F1019 HydrophobicContact CG2-CZ 3.8Å; V999-I1038 HydrophobicContact CG1-CG2 4.49Å; V999-I1038 HydrophobicContact CG2-CG1 4.27Å; V999-A1041 HydrophobicContact CB-CB 3.58Å; V999-A1041 HydrophobicContact CG1-CB 3.44Å; V999-A1041 VanDerWaalsContact CG1-CB 3.44Å; V999-L1042 HydrophobicContact CG1-CD2 4.14Å
1000	R	97.8	Very high	96.1	Very high	9 Å²	9	45.1 Å²	45.1	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-56.1	-43.6	175.3	-67.8	167.1	-171.4	-179.4	-5.5	111.2	S542 S996 Y997 W998 I1004 S1040 A1041 I1047 L1160	S542-R1000 PolarHBondContact OG-NH2 3.11Å; S996-R1000 VanDerWaalsContact O-CG 3.24Å; S996-R1000 WeakPolarHBondContact O-CG 3.29Å; S996-R1000 PolarHBondContact O-N 3.02Å; Y997-R1000 VanDerWaalsContact CE1-NH1 3.3Å; Y997-R1000 PolarHBondContact O-N 3.37Å; W998-R1000 PolarHBondContact O-N 2.76Å; R1000-I1004 WeakPolarHBondContact O-CB 3.46Å; R1000-I1004 WeakPolarHBondContact O-CG2 3.41Å; R1000-I1004 PolarHBondContact O-N 2.93Å; R1000-I1004 VanDerWaalsContact O-N 3.11Å; R1000-S1040 PolarHBondContact NE-O 3.04Å; R1000-S1040 PolarHBondContact NH2-O 3.23Å; R1000-A1041 HydrophobicContact CG-CB 3.83Å; R1000-I1047 HydrophobicContact CB-CD1 4.39Å; R1000-I1047 HydrophobicContact CG-CD1 4.4Å; R1000-L1160 HydrophobicContact CB-CD1 3.68Å; R1000-L1160 HydrophobicContact CB-CD2 4.11Å; R1000-L1160 HydrophobicContact CG-CD1 4.39Å
1001	S	96.6	Very high	96.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-67.5	-49.5	-178.4	-58.6	0	0	0	0	112.6	Y997 W998 V999 I1003 I1004 Q1005 H1154 L1155	Y997-S1001 VanDerWaalsContact O-CB 3.32Å; Y997-S1001 WeakPolarHBondContact O-CB 3.37Å; Y997-S1001 PolarHBondContact O-N 2.96Å; Y997-S1001 PolarHBondContact O-OG 3.43Å; W998-S1001 WeakPolarHBondContact O-CB 3.46Å; W998-S1001 PolarHBondContact O-N 2.7Å; V999-S1001 VanDerWaalsContact C-N 3.26Å; V999-S1001 PolarHBondContact O-N 3.42Å; S1001-I1003 VanDerWaalsContact C-N 3.29Å; S1001-I1003 PolarHBondContact O-N 2.89Å; S1001-I1004 PolarHBondContact O-N 2.94Å; S1001-Q1005 WeakPolarHBondContact O-CB 3.25Å; S1001-Q1005 WeakPolarHBondContact O-CG 3.36Å; S1001-Q1005 PolarHBondContact O-N 3.46Å; S1001-H1154 WeakPolarHBondContact OG-CA 3.31Å; S1001-L1155 PolarHBondContact OG-N 3.33Å
1002	L	96	Very high	96.2	Very high	17 Å²	17	41.9 Å²	41.9	9%	0.089	21%	0.205	C	C	.	.	H	α-helix	trans	-57	-42.2	-179.7	-75.9	178.3	0	0	0	112.3	W998 V999 Q1006 L1015 F1019	W998-L1002 HydrophobicContact CD2-CD1 3.77Å; W998-L1002 HydrophobicContact CD2-CG 4.34Å; W998-L1002 HydrophobicContact CE3-CD1 3.82Å; W998-L1002 HydrophobicContact CH2-CD1 3.67Å; W998-L1002 HydrophobicContact CZ2-CD1 3.62Å; W998-L1002 HydrophobicContact CZ3-CD1 3.77Å; W998-L1002 WeakPolarHBondContact O-CG 3.01Å; W998-L1002 PolarHBondContact O-N 2.94Å; V999-L1002 PolarHBondContact O-N 3.31Å; L1002-Q1006 PolarHBondContact O-NE2 2.89Å; L1002-L1015 VanDerWaalsContact O-CD1 3.25Å; L1002-L1015 WeakPolarHBondContact O-CD1 3.31Å; L1002-F1019 HydrophobicContact CD1-CZ 4.07Å
1003	I	96.8	Very high	96.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.2	-51.7	178	-65.4	168.1	0	0	0	110.1	V999 S1001 Q1005 Q1006 R1012 L1015 F1019 L1042 I1047 W1052	V999-I1003 HydrophobicContact CG1-CD1 4.08Å; V999-I1003 PolarHBondContact O-N 3.5Å; S1001-I1003 VanDerWaalsContact C-N 3.29Å; S1001-I1003 PolarHBondContact O-N 2.89Å; I1003-Q1005 VanDerWaalsContact C-N 3.29Å; I1003-Q1005 PolarHBondContact O-N 3.43Å; I1003-Q1006 PolarHBondContact O-N 3.44Å; I1003-R1012 HydrophobicContact CG2-CB 4.26Å; I1003-R1012 HydrophobicContact CG2-CG 4.43Å; I1003-R1012 WeakPolarHBondContact O-CG 3.08Å; I1003-L1015 HydrophobicContact CG1-CB 4.02Å; I1003-F1019 HydrophobicContact CD1-CD2 3.93Å; I1003-F1019 HydrophobicContact CD1-CE2 4.23Å; I1003-F1019 HydrophobicContact CG1-CD2 4.24Å; I1003-F1019 HydrophobicContact CG1-CE2 4.15Å; I1003-L1042 HydrophobicContact CD1-CD2 3.39Å; I1003-I1047 HydrophobicContact CB-CD1 3.96Å; I1003-I1047 HydrophobicContact CD1-CD1 3.85Å; I1003-I1047 HydrophobicContact CG2-CD1 4.02Å; I1003-W1052 HydrophobicContact CG2-CH2 3.93Å
1004	I	96.1	Very high	96.2	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-73.5	-20.7	-169.5	-148.3	153.8	0	0	0	114	R1000 S1001 Q1006 P1046 L1155 L1160 L1163 I1167	R1000-I1004 WeakPolarHBondContact O-CB 3.46Å; R1000-I1004 WeakPolarHBondContact O-CG2 3.41Å; R1000-I1004 PolarHBondContact O-N 2.93Å; R1000-I1004 VanDerWaalsContact O-N 3.11Å; S1001-I1004 PolarHBondContact O-N 2.94Å; I1004-Q1006 VanDerWaalsContact C-N 3.28Å; I1004-Q1006 PolarHBondContact O-N 2.9Å; I1004-P1046 HydrophobicContact CD1-CB 3.73Å; I1004-L1155 HydrophobicContact CG2-CD1 4.31Å; I1004-L1160 WeakPolarHBondContact CD1-O 3.32Å; I1004-L1160 HydrophobicContact CG2-CD2 3.54Å; I1004-L1163 HydrophobicContact CD1-CB 4.43Å; I1004-L1163 HydrophobicContact CG1-CB 4.11Å; I1004-L1163 HydrophobicContact CG2-CB 4.43Å; I1004-L1163 HydrophobicContact CG2-CD1 4.08Å; I1004-I1167 HydrophobicContact CG1-CD1 3.87Å; I1004-I1167 WeakPolarHBondContact O-CD1 3.34Å
1005	Q	95.3	Very high	96.2	Very high	89 Å²	89	44.6 Å²	44.6	42%	0.416	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-16.7	175.4	-73.3	169.2	1.1	0	0	113.3	S1001 I1003 E1007 L1155	S1001-Q1005 WeakPolarHBondContact O-CB 3.25Å; S1001-Q1005 WeakPolarHBondContact O-CG 3.36Å; S1001-Q1005 PolarHBondContact O-N 3.46Å; I1003-Q1005 VanDerWaalsContact C-N 3.29Å; I1003-Q1005 PolarHBondContact O-N 3.43Å; Q1005-E1007 PolarHBondContact O-N 3.05Å; Q1005-L1155 HydrophobicContact CG-CD1 4.12Å
1006	Q	95.2	Very high	96.1	Very high	68 Å²	68	44.7 Å²	44.7	32%	0.318	21%	0.214	S	C	.	.			trans	-77.5	118.8	177.3	-45.6	-51.4	-45.6	0	0	111	L1002 I1003 I1004 K1008 D1011 R1012 L1015	L1002-Q1006 PolarHBondContact O-NE2 2.89Å; I1003-Q1006 PolarHBondContact O-N 3.44Å; I1004-Q1006 VanDerWaalsContact C-N 3.28Å; I1004-Q1006 PolarHBondContact O-N 2.9Å; Q1006-K1008 PolarHBondContact O-N 3Å; Q1006-D1011 HydrophobicContact CB-CB 4.28Å; Q1006-R1012 HydrophobicContact CB-CG 3.78Å; Q1006-R1012 HydrophobicContact CG-CG 4.49Å; Q1006-R1012 PolarHBondContact O-NH1 2.89Å; Q1006-L1015 HydrophobicContact CG-CD1 3.43Å; Q1006-L1015 VanDerWaalsContact CG-CD1 3.43Å
1007	E	91.8	Very high	96.1	Very high	181 Å²	181	47.9 Å²	47.9	85%	0.846	23%	0.231	S	C	*	.	S	Bend	trans	-63.4	-40.5	179.7	-56.7	-171.2	139.9	0	0	112.5	Q1005 R1012	Q1005-E1007 PolarHBondContact O-N 3.05Å; E1007-R1012 VanDerWaalsContact C-NH1 3.32Å; E1007-R1012 PolarHBondContact O-NH1 3.29Å
1008	K	94.9	Very high	96.1	Very high	142 Å²	142	47.6 Å²	47.6	62%	0.617	23%	0.23	S	C	*	.	S	Bend	trans	-84.2	132.2	-175.6	-68.2	167.8	178.8	172.6	0	111.8	Q1006 Q1010 D1011 R1012	Q1006-K1008 PolarHBondContact O-N 3Å; K1008-Q1010 VanDerWaalsContact C-N 3.34Å; K1008-Q1010 PolarHBondContact O-N 2.95Å; K1008-D1011 HydrophobicContact CB-CB 4.34Å; K1008-D1011 WeakPolarHBondContact CB-OD2 3.44Å; K1008-D1011 WeakPolarHBondContact CD-OD2 3.45Å; K1008-D1011 PolarHBondContact O-N 3.41Å; K1008-D1011 VanDerWaalsContact O-N 3.16Å; K1008-R1012 PolarHBondContact O-N 2.96Å
1009	A	95.4	Very high	96.2	Very high	53 Å²	53	47.6 Å²	47.6	44%	0.438	23%	0.23	S	C	.	.	H	α-helix	trans	-58	-42.9	177.8	0	0	0	0	0	113	D1011 R1012 E1013	A1009-D1011 PolarHBondContact O-N 3.07Å; A1009-R1012 WeakPolarHBondContact O-CB 3.4Å; A1009-R1012 PolarHBondContact O-N 3.41Å; A1009-E1013 PolarHBondContact O-N 2.88Å
1010	Q	95.5	Very high	96.1	Very high	144 Å²	144	48.2 Å²	48.2	67%	0.673	23%	0.233	S	C	*	.	H	α-helix	trans	-60.9	-30.6	178.7	-69.1	178.6	-21.7	0	0	113.4	K1008 K1014	K1008-Q1010 VanDerWaalsContact C-N 3.34Å; K1008-Q1010 PolarHBondContact O-N 2.95Å; Q1010-K1014 VanDerWaalsContact O-CG 3.28Å; Q1010-K1014 WeakPolarHBondContact O-CG 3.49Å; Q1010-K1014 PolarHBondContact O-N 2.66Å; Q1010-K1014 VanDerWaalsContact O-N 3.15Å
1011	D	95.7	Very high	96.1	Very high	41 Å²	41	54 Å²	54	22%	0.219	26%	0.259	C	S	.	.	H	α-helix	trans	-84.7	-28.9	-179.2	-60.2	-44.5	0	0	0	111.4	Q1006 K1008 A1009 K1014 L1015	Q1006-D1011 HydrophobicContact CB-CB 4.28Å; K1008-D1011 HydrophobicContact CB-CB 4.34Å; K1008-D1011 WeakPolarHBondContact CB-OD2 3.44Å; K1008-D1011 WeakPolarHBondContact CD-OD2 3.45Å; K1008-D1011 PolarHBondContact O-N 3.41Å; K1008-D1011 VanDerWaalsContact O-N 3.16Å; A1009-D1011 PolarHBondContact O-N 3.07Å; D1011-K1014 WeakPolarHBondContact OD1-CE 3.31Å; D1011-K1014 IonicContact OD1-NZ 2.69Å; D1011-K1014 PolarHBondContact OD1-NZ 2.86Å; D1011-L1015 WeakPolarHBondContact O-CG 3.33Å; D1011-L1015 PolarHBondContact O-N 3.38Å
1012	R	96.5	Very high	96.2	Very high	22 Å²	22	53.9 Å²	53.9	8%	0.083	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-45.5	163.7	-63.3	-166.1	-68.8	-86.9	1.2	111.8	I1003 Q1006 E1007 K1008 A1009 K1014 L1015 L1016 W1052	I1003-R1012 HydrophobicContact CG2-CB 4.26Å; I1003-R1012 HydrophobicContact CG2-CG 4.43Å; I1003-R1012 WeakPolarHBondContact O-CG 3.08Å; Q1006-R1012 HydrophobicContact CB-CG 3.78Å; Q1006-R1012 HydrophobicContact CG-CG 4.49Å; Q1006-R1012 PolarHBondContact O-NH1 2.89Å; E1007-R1012 VanDerWaalsContact C-NH1 3.32Å; E1007-R1012 PolarHBondContact O-NH1 3.29Å; K1008-R1012 PolarHBondContact O-N 2.96Å; A1009-R1012 WeakPolarHBondContact O-CB 3.4Å; A1009-R1012 PolarHBondContact O-N 3.41Å; R1012-K1014 PolarHBondContact O-N 3.14Å; R1012-L1015 PolarHBondContact O-N 3.09Å; R1012-L1016 PolarHBondContact O-N 2.99Å; R1012-W1052 HydrophobicContact CB-CH2 4.02Å; R1012-W1052 HydrophobicContact CB-CZ3 3.86Å
1013	E	96.2	Very high	96.3	Very high	16 Å²	16	53.1 Å²	53.1	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-58.1	-46.5	178.4	-158.2	79.9	-152.7	0	0	111.3	A1009 L1015 L1016 L1017 Q1053 T1056	A1009-E1013 PolarHBondContact O-N 2.88Å; E1013-L1015 PolarHBondContact O-N 3.3Å; E1013-L1016 PolarHBondContact O-N 3.45Å; E1013-L1017 HydrophobicContact CG-CD1 4.26Å; E1013-L1017 WeakPolarHBondContact O-CB 3.45Å; E1013-L1017 WeakPolarHBondContact O-CG 3.47Å; E1013-L1017 PolarHBondContact O-N 3.4Å; E1013-Q1053 HydrophobicContact CG-CG 4.31Å; E1013-Q1053 WeakPolarHBondContact OE1-CB 3.4Å; E1013-Q1053 PolarHBondContact OE1-N 2.84Å; E1013-Q1053 PolarHBondContact OE2-N 3.07Å; E1013-T1056 WeakPolarHBondContact OE1-CB 3.31Å; E1013-T1056 WeakPolarHBondContact OE1-CG2 3.39Å; E1013-T1056 PolarHBondContact OE1-OG1 3.07Å
1014	K	96.2	Very high	96.3	Very high	105 Å²	105	57.8 Å²	57.8	46%	0.457	27%	0.274	S	S	.	.	H	α-helix	trans	-59.1	-43.3	176.1	-72.4	167.9	-162.6	167.1	0	112.6	Q1010 D1011 R1012 K1018	Q1010-K1014 VanDerWaalsContact O-CG 3.28Å; Q1010-K1014 WeakPolarHBondContact O-CG 3.49Å; Q1010-K1014 PolarHBondContact O-N 2.66Å; Q1010-K1014 VanDerWaalsContact O-N 3.15Å; D1011-K1014 WeakPolarHBondContact OD1-CE 3.31Å; D1011-K1014 IonicContact OD1-NZ 2.69Å; D1011-K1014 PolarHBondContact OD1-NZ 2.86Å; R1012-K1014 PolarHBondContact O-N 3.14Å; K1014-K1018 WeakPolarHBondContact O-CB 3.41Å; K1014-K1018 PolarHBondContact O-N 3.31Å
1015	L	97.1	Very high	96.4	Very high	11 Å²	11	60.3 Å²	60.3	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-43.2	177.3	-72.1	175.6	0	0	0	111.6	L942 L1002 I1003 Q1006 D1011 R1012 E1013 K1018 F1019	L942-L1015 HydrophobicContact CB-CD2 4.2Å; L942-L1015 HydrophobicContact CD2-CD2 3.69Å; L1002-L1015 VanDerWaalsContact O-CD1 3.25Å; L1002-L1015 WeakPolarHBondContact O-CD1 3.31Å; I1003-L1015 HydrophobicContact CG1-CB 4.02Å; Q1006-L1015 HydrophobicContact CG-CD1 3.43Å; Q1006-L1015 VanDerWaalsContact CG-CD1 3.43Å; D1011-L1015 WeakPolarHBondContact O-CG 3.33Å; D1011-L1015 PolarHBondContact O-N 3.38Å; R1012-L1015 PolarHBondContact O-N 3.09Å; E1013-L1015 PolarHBondContact O-N 3.3Å; L1015-K1018 WeakPolarHBondContact O-CA 3.48Å; L1015-K1018 WeakPolarHBondContact O-CB 3.47Å; L1015-K1018 PolarHBondContact O-N 3.37Å; L1015-K1018 VanDerWaalsContact O-N 3.12Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.43Å; L1015-F1019 PolarHBondContact O-N 3.4Å
1016	L	96.7	Very high	96.6	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-43.2	179.6	-166	139.8	0	0	0	111.4	R1012 E1013 K1018 F1019 I1020 L1042 I1047 W1052 T1056	R1012-L1016 PolarHBondContact O-N 2.99Å; E1013-L1016 PolarHBondContact O-N 3.45Å; L1016-K1018 VanDerWaalsContact C-N 3.31Å; L1016-K1018 PolarHBondContact O-N 3.03Å; L1016-F1019 PolarHBondContact O-N 3Å; L1016-I1020 HydrophobicContact CD2-CD1 3.72Å; L1016-I1020 HydrophobicContact CD2-CG1 4.47Å; L1016-I1020 WeakPolarHBondContact O-CG1 3.49Å; L1016-I1020 PolarHBondContact O-N 2.92Å; L1016-L1042 HydrophobicContact CD1-CD2 4.03Å; L1016-L1042 HydrophobicContact CG-CD1 4.27Å; L1016-L1042 HydrophobicContact CG-CD2 3.94Å; L1016-I1047 HydrophobicContact CD1-CG2 3.89Å; L1016-W1052 HydrophobicContact CB-CZ3 4.16Å; L1016-W1052 HydrophobicContact CD1-CD2 4.27Å; L1016-W1052 HydrophobicContact CD1-CE3 4.14Å; L1016-W1052 HydrophobicContact CD1-CH2 3.75Å; L1016-W1052 HydrophobicContact CD1-CZ2 3.89Å; L1016-W1052 HydrophobicContact CD1-CZ3 3.87Å; L1016-T1056 HydrophobicContact CD2-CG2 3.33Å
1017	L	96.3	Very high	96.6	Very high	67 Å²	67	57.2 Å²	57.2	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-62.4	-34.3	170.4	-73.3	167.6	0	0	0	113.1	E1013 K1021 T1056	E1013-L1017 HydrophobicContact CG-CD1 4.26Å; E1013-L1017 WeakPolarHBondContact O-CB 3.45Å; E1013-L1017 WeakPolarHBondContact O-CG 3.47Å; E1013-L1017 PolarHBondContact O-N 3.4Å; L1017-K1021 WeakPolarHBondContact O-CG 3.38Å; L1017-K1021 PolarHBondContact O-N 2.99Å; L1017-K1021 VanDerWaalsContact O-N 3.11Å; L1017-T1056 HydrophobicContact CD2-CG2 3.78Å; L1017-T1056 HydrophobicContact CG-CG2 3.91Å
1018	K	97.7	Very high	96.8	Very high	21 Å²	21	55.9 Å²	55.9	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-65.7	-40.5	174.4	175.3	67.5	-179.9	-170.9	0	111.3	L942 F945 S947 K1014 L1015 L1016 K1021 I1022	L942-K1018 HydrophobicContact CD2-CG 3.75Å; L942-K1018 HydrophobicContact CG-CG 4.03Å; L942-K1018 WeakPolarHBondContact O-CE 3.23Å; L942-K1018 PolarHBondContact O-NZ 3.05Å; F945-K1018 PolarHBondContact O-NZ 3.46Å; S947-K1018 WeakPolarHBondContact OG-CD 3.37Å; S947-K1018 WeakPolarHBondContact OG-CE 3.49Å; S947-K1018 PolarHBondContact OG-NZ 3.3Å; K1014-K1018 WeakPolarHBondContact O-CB 3.41Å; K1014-K1018 PolarHBondContact O-N 3.31Å; L1015-K1018 WeakPolarHBondContact O-CA 3.48Å; L1015-K1018 WeakPolarHBondContact O-CB 3.47Å; L1015-K1018 PolarHBondContact O-N 3.37Å; L1015-K1018 VanDerWaalsContact O-N 3.12Å; L1016-K1018 VanDerWaalsContact C-N 3.31Å; L1016-K1018 PolarHBondContact O-N 3.03Å; K1018-K1021 PolarHBondContact O-N 2.68Å; K1018-I1022 HydrophobicContact CG-CD1 4.27Å; K1018-I1022 WeakPolarHBondContact O-CD1 3.42Å; K1018-I1022 WeakPolarHBondContact O-CG1 3.48Å; K1018-I1022 PolarHBondContact O-N 2.84Å; K1018-I1022 VanDerWaalsContact O-N 3.09Å
1019	F	98.1	Very high	97	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.013	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-41	175.6	-77.3	-62.3	0	0	0	113.3	L942 W998 V999 L1002 I1003 L1015 L1016 K1021 I1022 M1023 I1038 L1042	L942-F1019 HydrophobicContact CD1-CE1 4.3Å; L942-F1019 HydrophobicContact CD1-CZ 4.23Å; L942-F1019 HydrophobicContact CD2-CD1 4.48Å; L942-F1019 HydrophobicContact CD2-CD2 4.18Å; L942-F1019 HydrophobicContact CD2-CE1 3.85Å; L942-F1019 HydrophobicContact CD2-CE2 3.5Å; L942-F1019 HydrophobicContact CD2-CZ 3.31Å; L942-F1019 HydrophobicContact CG-CZ 4.42Å; W998-F1019 HydrophobicContact CZ3-CE1 4.21Å; W998-F1019 HydrophobicContact CZ3-CZ 4.19Å; V999-F1019 HydrophobicContact CB-CE1 4.41Å; V999-F1019 HydrophobicContact CB-CZ 4.21Å; V999-F1019 HydrophobicContact CG1-CD1 4.18Å; V999-F1019 HydrophobicContact CG1-CD2 3.88Å; V999-F1019 HydrophobicContact CG1-CE1 4.11Å; V999-F1019 HydrophobicContact CG1-CE2 3.79Å; V999-F1019 HydrophobicContact CG1-CG 4.09Å; V999-F1019 HydrophobicContact CG1-CZ 3.9Å; V999-F1019 HydrophobicContact CG2-CD1 4.18Å; V999-F1019 HydrophobicContact CG2-CE1 3.61Å; V999-F1019 HydrophobicContact CG2-CZ 3.8Å; L1002-F1019 HydrophobicContact CD1-CZ 4.07Å; I1003-F1019 HydrophobicContact CD1-CD2 3.93Å; I1003-F1019 HydrophobicContact CD1-CE2 4.23Å; I1003-F1019 HydrophobicContact CG1-CD2 4.24Å; I1003-F1019 HydrophobicContact CG1-CE2 4.15Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.43Å; L1015-F1019 PolarHBondContact O-N 3.4Å; L1016-F1019 PolarHBondContact O-N 3Å; F1019-K1021 VanDerWaalsContact C-N 3.26Å; F1019-K1021 PolarHBondContact O-N 3.14Å; F1019-I1022 HydrophobicContact CD1-CD1 3.88Å; F1019-I1022 HydrophobicContact CE1-CD1 4.2Å; F1019-I1022 WeakPolarHBondContact O-CA 3.33Å; F1019-I1022 WeakPolarHBondContact O-CB 3.33Å; F1019-I1022 PolarHBondContact O-N 3.02Å; F1019-M1023 WeakPolarHBondContact O-CG 3.4Å; F1019-M1023 PolarHBondContact O-N 3.42Å; F1019-I1038 HydrophobicContact CB-CG2 3.85Å; F1019-I1038 HydrophobicContact CD1-CD1 4.32Å; F1019-I1038 HydrophobicContact CD1-CG2 4.03Å; F1019-I1038 HydrophobicContact CG-CG2 4.21Å; F1019-L1042 HydrophobicContact CB-CD1 4.14Å; F1019-L1042 HydrophobicContact CB-CD2 4.16Å
1020	I	96.8	Very high	97.1	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.077	23%	0.229	C	C	.	.	H	α-helix	trans	-56.6	-42.2	170.9	-67.6	167.1	0	0	0	110.6	L1016 I1022 M1023 K1024 L1042 T1056 L1060 Y1063	L1016-I1020 HydrophobicContact CD2-CD1 3.72Å; L1016-I1020 HydrophobicContact CD2-CG1 4.47Å; L1016-I1020 WeakPolarHBondContact O-CG1 3.49Å; L1016-I1020 PolarHBondContact O-N 2.92Å; I1020-I1022 VanDerWaalsContact C-N 3.34Å; I1020-I1022 PolarHBondContact O-N 2.85Å; I1020-M1023 PolarHBondContact O-N 2.98Å; I1020-K1024 PolarHBondContact O-N 3.32Å; I1020-L1042 HydrophobicContact CG1-CD1 4.04Å; I1020-T1056 HydrophobicContact CD1-CG2 4.23Å; I1020-L1060 HydrophobicContact CD1-CB 4.04Å; I1020-L1060 HydrophobicContact CD1-CD1 4.46Å; I1020-L1060 HydrophobicContact CG1-CD1 4.19Å; I1020-Y1063 HydrophobicContact CG2-CD2 4.07Å; I1020-Y1063 HydrophobicContact CG2-CE2 3.8Å
1021	K	97.7	Very high	97.2	Very high	129 Å²	129	43.5 Å²	43.5	56%	0.561	20%	0.197	S	C	*	.	H	α-helix	trans	-63.6	-35.2	174.3	-72.6	174.9	-178.1	-177.3	0	113	L1017 K1018 F1019 H1025	L1017-K1021 WeakPolarHBondContact O-CG 3.38Å; L1017-K1021 PolarHBondContact O-N 2.99Å; L1017-K1021 VanDerWaalsContact O-N 3.11Å; K1018-K1021 PolarHBondContact O-N 2.68Å; F1019-K1021 VanDerWaalsContact C-N 3.26Å; F1019-K1021 PolarHBondContact O-N 3.14Å; K1021-H1025 PolarHBondContact O-CD2 3.03Å
1022	I	98.6	Very high	97.3	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-45.8	174.6	-67.4	157.8	0	0	0	110.5	L942 I950 A951 L954 K1018 F1019 I1020 K1024 H1025 L1026 I1038	L942-I1022 HydrophobicContact CD1-CD1 4.49Å; I950-I1022 HydrophobicContact CB-CD1 4.29Å; I950-I1022 HydrophobicContact CB-CG1 4.29Å; I950-I1022 HydrophobicContact CD1-CD1 3.91Å; I950-I1022 HydrophobicContact CD1-CG1 4.42Å; I950-I1022 HydrophobicContact CG2-CD1 3.79Å; I950-I1022 HydrophobicContact CG2-CG1 4.14Å; I950-I1022 HydrophobicContact CG2-CG2 4.17Å; A951-I1022 HydrophobicContact CB-CG2 4.23Å; L954-I1022 HydrophobicContact CD1-CG2 3.95Å; K1018-I1022 HydrophobicContact CG-CD1 4.27Å; K1018-I1022 WeakPolarHBondContact O-CD1 3.42Å; K1018-I1022 WeakPolarHBondContact O-CG1 3.48Å; K1018-I1022 PolarHBondContact O-N 2.84Å; K1018-I1022 VanDerWaalsContact O-N 3.09Å; F1019-I1022 HydrophobicContact CD1-CD1 3.88Å; F1019-I1022 HydrophobicContact CE1-CD1 4.2Å; F1019-I1022 WeakPolarHBondContact O-CA 3.33Å; F1019-I1022 WeakPolarHBondContact O-CB 3.33Å; F1019-I1022 PolarHBondContact O-N 3.02Å; I1020-I1022 VanDerWaalsContact C-N 3.34Å; I1020-I1022 PolarHBondContact O-N 2.85Å; I1022-K1024 VanDerWaalsContact C-N 3.27Å; I1022-K1024 PolarHBondContact O-N 2.83Å; I1022-H1025 WeakPolarHBondContact O-CA 3.48Å; I1022-H1025 WeakPolarHBondContact O-CB 3.49Å; I1022-H1025 PolarHBondContact O-N 2.85Å; I1022-L1026 HydrophobicContact CG2-CD1 3.96Å; I1022-L1026 HydrophobicContact CG2-CG 4.31Å; I1022-L1026 PolarHBondContact O-N 2.7Å; I1022-I1038 HydrophobicContact CG2-CD1 3.78Å
1023	M	97.9	Very high	97.4	Very high	0 Å²	0	41 Å²	41	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.4	-39.3	175.1	-69.1	170.6	61.6	0	0	112.5	F1019 I1020 H1025 L1026 R1027 Y1035 I1038 L1039 L1042 Y1063	F1019-M1023 WeakPolarHBondContact O-CG 3.4Å; F1019-M1023 PolarHBondContact O-N 3.42Å; I1020-M1023 PolarHBondContact O-N 2.98Å; M1023-H1025 PolarHBondContact O-N 2.69Å; M1023-L1026 PolarHBondContact O-N 3.06Å; M1023-R1027 WeakPolarHBondContact O-CB 3.47Å; M1023-R1027 PolarHBondContact O-N 2.87Å; M1023-Y1035 HydrophobicContact CB-CD2 3.95Å; M1023-Y1035 HydrophobicContact CB-CE2 4.1Å; M1023-Y1035 HydrophobicContact CE-CD2 4.26Å; M1023-Y1035 HydrophobicContact CE-CE1 4.44Å; M1023-Y1035 HydrophobicContact CE-CE2 3.98Å; M1023-Y1035 HydrophobicContact CG-CD2 4.43Å; M1023-I1038 HydrophobicContact CG-CB 3.92Å; M1023-I1038 HydrophobicContact CG-CD1 4.35Å; M1023-I1038 HydrophobicContact CG-CG2 3.66Å; M1023-I1038 HydrophobicContact SD-CB 4.16Å; M1023-I1038 HydrophobicContact SD-CG2 3.6Å; M1023-I1038 VanDerWaalsContact SD-CG2 3.6Å; M1023-L1039 HydrophobicContact CE-CB 3.73Å; M1023-L1039 HydrophobicContact CE-CD1 4.1Å; M1023-L1039 HydrophobicContact CE-CG 4.33Å; M1023-L1042 HydrophobicContact SD-CD1 3.92Å; M1023-Y1063 HydrophobicContact CE-CG 4.3Å
1024	K	96.9	Very high	97.5	Very high	98 Å²	98	40.2 Å²	40.2	43%	0.426	18%	0.181	S	C	.	.	H	α-helix	trans	-63.9	-22.4	174.8	-165.9	172.2	-166.9	119.1	0	113.7	I1020 I1022 K1028 Y1063	I1020-K1024 PolarHBondContact O-N 3.32Å; I1022-K1024 VanDerWaalsContact C-N 3.27Å; I1022-K1024 PolarHBondContact O-N 2.83Å; K1024-K1028 WeakPolarHBondContact O-CG 3.39Å; K1024-Y1063 HydrophobicContact CB-CE1 4.27Å; K1024-Y1063 HydrophobicContact CG-CE1 4.43Å; K1024-Y1063 PolarHBondContact NZ-OH 3.5Å
1025	H	98.5	Very high	97.5	Very high	58 Å²	58	35.2 Å²	35.2	27%	0.269	16%	0.159	S	C	.	.	H	α-helix	trans	-86.8	-42.6	170.1	-73.3	-72.4	0	0	0	112	A951 K1021 I1022 M1023 R1027 K1028 L1029	A951-H1025 HydrophobicContact CB-CB 3.52Å; K1021-H1025 PolarHBondContact O-CD2 3.03Å; I1022-H1025 WeakPolarHBondContact O-CA 3.48Å; I1022-H1025 WeakPolarHBondContact O-CB 3.49Å; I1022-H1025 PolarHBondContact O-N 2.85Å; M1023-H1025 PolarHBondContact O-N 2.69Å; H1025-R1027 VanDerWaalsContact C-N 3.3Å; H1025-R1027 PolarHBondContact O-N 3.37Å; H1025-K1028 WeakPolarHBondContact O-CA 3.42Å; H1025-K1028 WeakPolarHBondContact O-CB 3.39Å; H1025-K1028 PolarHBondContact O-N 3.32Å; H1025-L1029 PolarHBondContact O-N 3.18Å
1026	L	98.4	Very high	97.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57.1	-41.4	175.8	-67	168.3	0	0	0	112.6	A951 L954 T955 I1022 M1023 K1028 L1029 N1030 N1031 I1038	A951-L1026 HydrophobicContact CB-CD2 3.83Å; A951-L1026 HydrophobicContact CB-CG 3.9Å; L954-L1026 HydrophobicContact CB-CD2 4.19Å; L954-L1026 HydrophobicContact CD1-CD1 4.27Å; T955-L1026 WeakPolarHBondContact OG1-CD2 3.04Å; I1022-L1026 HydrophobicContact CG2-CD1 3.96Å; I1022-L1026 HydrophobicContact CG2-CG 4.31Å; I1022-L1026 PolarHBondContact O-N 2.7Å; M1023-L1026 PolarHBondContact O-N 3.06Å; L1026-K1028 PolarHBondContact O-N 2.95Å; L1026-L1029 CarbonylContact O-C 3.38Å; L1026-L1029 PolarHBondContact O-N 2.96Å; L1026-L1029 VanDerWaalsContact O-N 3.07Å; L1026-N1030 PolarHBondContact O-N 2.82Å; L1026-N1031 HydrophobicContact CD2-CB 4.18Å; L1026-N1031 PolarHBondContact O-N 3.28Å; L1026-I1038 HydrophobicContact CD1-CD1 3.6Å
1027	R	95.8	Very high	97.6	Very high	92 Å²	92	34.6 Å²	34.6	35%	0.347	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.5	174.3	-169.4	171.9	177.7	175.8	0.9	113.7	M1023 H1025 Y1035	M1023-R1027 WeakPolarHBondContact O-CB 3.47Å; M1023-R1027 PolarHBondContact O-N 2.87Å; H1025-R1027 VanDerWaalsContact C-N 3.3Å; H1025-R1027 PolarHBondContact O-N 3.37Å; R1027-Y1035 HydrophobicContact CB-CD2 3.99Å; R1027-Y1035 HydrophobicContact CB-CE2 3.88Å; R1027-Y1035 HydrophobicContact CG-CE2 4.33Å
1028	K	96.4	Very high	97.6	Very high	153 Å²	153	31.4 Å²	31.4	67%	0.665	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-23	171.8	-68.6	178.1	175.2	-169.8	0	113.2	K1024 H1025 L1026 N1030	K1024-K1028 WeakPolarHBondContact O-CG 3.39Å; H1025-K1028 WeakPolarHBondContact O-CA 3.42Å; H1025-K1028 WeakPolarHBondContact O-CB 3.39Å; H1025-K1028 PolarHBondContact O-N 3.32Å; L1026-K1028 PolarHBondContact O-N 2.95Å; K1028-N1030 VanDerWaalsContact C-N 3.26Å
1029	L	97.8	Very high	97.6	Very high	36 Å²	36	30.7 Å²	30.7	19%	0.188	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.2	173.8	-66.1	170.4	0	0	0	112	A951 T955 H1025 L1026 N1031 Y1136	A951-L1029 HydrophobicContact CB-CD1 4.03Å; T955-L1029 HydrophobicContact CG2-CB 4.44Å; T955-L1029 WeakPolarHBondContact OG1-CD1 3.34Å; H1025-L1029 PolarHBondContact O-N 3.18Å; L1026-L1029 CarbonylContact O-C 3.38Å; L1026-L1029 PolarHBondContact O-N 2.96Å; L1026-L1029 VanDerWaalsContact O-N 3.07Å; L1029-N1031 PolarHBondContact O-N 3.44Å; L1029-N1031 VanDerWaalsContact O-N 3.11Å; L1029-Y1136 VanDerWaalsContact O-CE1 3.24Å; L1029-Y1136 WeakPolarHBondContact O-CE1 3.25Å; L1029-Y1136 PolarHBondContact O-OH 3.3Å
1030	N	97.6	Very high	97.4	Very high	43 Å²	43	30.6 Å²	30.6	23%	0.23	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	24.1	-172.1	-52.6	-30.4	0	0	0	113.6	L1026 K1028 F1032 V1083 E1084 P1086 C1087 I1088	L1026-N1030 PolarHBondContact O-N 2.82Å; K1028-N1030 VanDerWaalsContact C-N 3.26Å; N1030-F1032 HydrophobicContact CB-CE2 4.43Å; N1030-F1032 PolarHBondContact O-N 3.44Å; N1030-V1083 HydrophobicContact CB-CG2 3.86Å; N1030-V1083 VanDerWaalsContact ND2-CG2 3.3Å; N1030-V1083 WeakPolarHBondContact ND2-CG2 3.29Å; N1030-V1083 WeakPolarHBondContact OD1-CG2 3.42Å; N1030-E1084 PolarHBondContact ND2-O 3.47Å; N1030-P1086 WeakPolarHBondContact CB-O 3.42Å; N1030-P1086 PolarHBondContact ND2-O 3.16Å; N1030-C1087 HydrophobicContact CB-CB 3.73Å; N1030-C1087 WeakPolarHBondContact O-CA 3.31Å; N1030-C1087 PolarHBondContact O-SG 2.84Å; N1030-I1088 PolarHBondContact O-N 3.43Å
1031	N	98.3	Very high	97.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-89.3	92	174.3	-178	-3.9	0	0	0	109.1	T955 D958 L1026 L1029 N1033 S1034 Y1035 I1088	T955-N1031 WeakPolarHBondContact CA-ND2 3.2Å; T955-N1031 HydrophobicContact CG2-CB 3.97Å; T955-N1031 WeakPolarHBondContact OG1-CB 3.43Å; T955-N1031 PolarHBondContact OG1-ND2 3Å; T955-N1031 VanDerWaalsContact OG1-ND2 3.1Å; D958-N1031 PolarHBondContact OD2-ND2 2.88Å; D958-N1031 PolarHBondContact OD2-OD1 3.13Å; D958-N1031 VanDerWaalsContact OD2-OD1 3.13Å; L1026-N1031 HydrophobicContact CD2-CB 4.18Å; L1026-N1031 PolarHBondContact O-N 3.28Å; L1029-N1031 PolarHBondContact O-N 3.44Å; L1029-N1031 VanDerWaalsContact O-N 3.11Å; N1031-N1033 VanDerWaalsContact C-N 3.33Å; N1031-N1033 WeakPolarHBondContact OD1-CB 3.38Å; N1031-N1033 PolarHBondContact OD1-N 2.98Å; N1031-S1034 WeakPolarHBondContact ND2-CB 3.4Å; N1031-S1034 PolarHBondContact ND2-OG 3.22Å; N1031-S1034 PolarHBondContact OD1-N 3.48Å; N1031-S1034 VanDerWaalsContact OD1-N 3.09Å; N1031-Y1035 VanDerWaalsContact O-CB 3.23Å; N1031-Y1035 WeakPolarHBondContact O-CB 3.35Å; N1031-I1088 HydrophobicContact CB-CD1 4.47Å
1032	F	97.7	Very high	97.4	Very high	10 Å²	10	23.9 Å²	23.9	4%	0.044	11%	0.106	C	C	.	.	H	α-helix	trans	-79.4	-18.4	176.6	-57.9	-70.3	0	0	0	112.5	N1030 L1036 L1066 Y1076 L1080 V1083 I1088	N1030-F1032 HydrophobicContact CB-CE2 4.43Å; N1030-F1032 PolarHBondContact O-N 3.44Å; F1032-L1036 WeakPolarHBondContact O-CG 3.39Å; F1032-L1036 PolarHBondContact O-N 3.22Å; F1032-L1036 VanDerWaalsContact O-N 3.09Å; F1032-L1066 HydrophobicContact CD1-CD2 4Å; F1032-L1066 HydrophobicContact CE1-CD2 3.93Å; F1032-Y1076 HydrophobicContact CB-CE2 3.82Å; F1032-Y1076 HydrophobicContact CD1-CE2 4.17Å; F1032-Y1076 HydrophobicContact CD2-CE2 4.23Å; F1032-Y1076 AromaticContact CG-CE2 3.81Å; F1032-Y1076 HydrophobicContact CG-CE2 3.81Å; F1032-L1080 HydrophobicContact CD2-CD1 4.08Å; F1032-L1080 HydrophobicContact CE2-CD1 4.14Å; F1032-V1083 HydrophobicContact CE2-CG1 4.43Å; F1032-I1088 WeakPolarHBondContact CB-O 3.48Å; F1032-I1088 PolarHBondContact N-O 2.97Å
1033	N	97.8	Very high	97.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.3	-66.9	179.5	-163.2	63.8	0	0	0	111.9	D958 F988 F992 N1031 Y1035 L1036 A1037 I1088	D958-N1033 PolarHBondContact OD1-ND2 3.04Å; F988-N1033 VanDerWaalsContact CE1-OD1 3.26Å; F988-N1033 WeakPolarHBondContact CE1-OD1 3.27Å; F988-N1033 HydrophobicContact CZ-CB 3.94Å; F988-N1033 VanDerWaalsContact CZ-ND2 3.31Å; F988-N1033 WeakPolarHBondContact CZ-ND2 3.37Å; F988-N1033 WeakPolarHBondContact CZ-OD1 3.36Å; F992-N1033 WeakPolarHBondContact CD2-OD1 3.07Å; F992-N1033 VanDerWaalsContact CE2-O 3.32Å; F992-N1033 WeakPolarHBondContact CE2-O 3.41Å; N1031-N1033 VanDerWaalsContact C-N 3.33Å; N1031-N1033 WeakPolarHBondContact OD1-CB 3.38Å; N1031-N1033 PolarHBondContact OD1-N 2.98Å; N1033-Y1035 PolarHBondContact O-N 2.97Å; N1033-L1036 PolarHBondContact O-N 2.78Å; N1033-L1036 VanDerWaalsContact O-N 3.07Å; N1033-A1037 PolarHBondContact O-N 3.38Å; N1033-I1088 HydrophobicContact CB-CG2 3.84Å
1034	S	98.4	Very high	96.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-54.9	-34.7	173	-79.3	0	0	0	0	112.7	D958 M995 N1031 L1036 A1037 I1038	D958-S1034 VanDerWaalsContact OD2-CB 3.25Å; D958-S1034 WeakPolarHBondContact OD2-CB 3.43Å; D958-S1034 PolarHBondContact OD2-N 3.1Å; D958-S1034 PolarHBondContact OD2-OG 2.92Å; M995-S1034 WeakPolarHBondContact CE-OG 3.32Å; M995-S1034 PolarHBondContact SD-OG 2.84Å; N1031-S1034 WeakPolarHBondContact ND2-CB 3.4Å; N1031-S1034 PolarHBondContact ND2-OG 3.22Å; N1031-S1034 PolarHBondContact OD1-N 3.48Å; N1031-S1034 VanDerWaalsContact OD1-N 3.09Å; S1034-L1036 VanDerWaalsContact C-N 3.35Å; S1034-L1036 PolarHBondContact O-N 2.76Å; S1034-A1037 PolarHBondContact O-N 3.36Å; S1034-I1038 VanDerWaalsContact O-CG1 3.31Å; S1034-I1038 WeakPolarHBondContact O-CG1 3.3Å; S1034-I1038 PolarHBondContact O-N 2.84Å
1035	Y	97.7	Very high	96.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.2	-45.3	177.5	176.7	-86.6	0	0	0	111.7	M1023 R1027 N1031 N1033 L1039 Y1063 L1066	M1023-Y1035 HydrophobicContact CB-CD2 3.95Å; M1023-Y1035 HydrophobicContact CB-CE2 4.1Å; M1023-Y1035 HydrophobicContact CE-CD2 4.26Å; M1023-Y1035 HydrophobicContact CE-CE1 4.44Å; M1023-Y1035 HydrophobicContact CE-CE2 3.98Å; M1023-Y1035 HydrophobicContact CG-CD2 4.43Å; R1027-Y1035 HydrophobicContact CB-CD2 3.99Å; R1027-Y1035 HydrophobicContact CB-CE2 3.88Å; R1027-Y1035 HydrophobicContact CG-CE2 4.33Å; N1031-Y1035 VanDerWaalsContact O-CB 3.23Å; N1031-Y1035 WeakPolarHBondContact O-CB 3.35Å; N1033-Y1035 PolarHBondContact O-N 2.97Å; Y1035-L1039 HydrophobicContact CE1-CD2 4.3Å; Y1035-L1039 WeakPolarHBondContact O-CB 3.24Å; Y1035-L1039 PolarHBondContact O-N 2.85Å; Y1035-Y1063 AromaticContact CE2-CD1 3.86Å; Y1035-Y1063 HydrophobicContact CE2-CD1 3.86Å; Y1035-Y1063 VanDerWaalsContact OH-CA 3.3Å; Y1035-Y1063 WeakPolarHBondContact OH-CA 3.49Å; Y1035-Y1063 VanDerWaalsContact OH-CB 3.28Å; Y1035-Y1063 WeakPolarHBondContact OH-CB 3.38Å; Y1035-Y1063 PolarHBondContact OH-O 2.85Å; Y1035-L1066 HydrophobicContact CD1-CD2 4.44Å; Y1035-L1066 HydrophobicContact CE1-CB 4.49Å; Y1035-L1066 HydrophobicContact CE1-CD2 3.8Å
1036	L	96.5	Very high	96.6	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-79.6	-26.3	177.1	-66.3	-176.6	0	0	0	113.5	P541 F992 F1032 N1033 S1034 I1038 L1039 S1040 I1067 Y1090	P541-L1036 HydrophobicContact CB-CB 4.25Å; F992-L1036 HydrophobicContact CE2-CB 4.02Å; F992-L1036 HydrophobicContact CZ-CB 4.12Å; F1032-L1036 WeakPolarHBondContact O-CG 3.39Å; F1032-L1036 PolarHBondContact O-N 3.22Å; F1032-L1036 VanDerWaalsContact O-N 3.09Å; N1033-L1036 PolarHBondContact O-N 2.78Å; N1033-L1036 VanDerWaalsContact O-N 3.07Å; S1034-L1036 VanDerWaalsContact C-N 3.35Å; S1034-L1036 PolarHBondContact O-N 2.76Å; L1036-I1038 VanDerWaalsContact C-N 3.35Å; L1036-L1039 HydrophobicContact CD2-CB 4.41Å; L1036-L1039 HydrophobicContact CD2-CD2 3.87Å; L1036-L1039 PolarHBondContact O-N 3.11Å; L1036-S1040 VanDerWaalsContact O-CB 3.29Å; L1036-S1040 WeakPolarHBondContact O-CB 3.43Å; L1036-S1040 PolarHBondContact O-N 3.29Å; L1036-S1040 PolarHBondContact O-OG 2.77Å; L1036-I1067 HydrophobicContact CD1-CD1 3.76Å; L1036-I1067 HydrophobicContact CD1-CG1 3.94Å; L1036-I1067 HydrophobicContact CD2-CB 3.85Å; L1036-I1067 HydrophobicContact CD2-CD1 4.4Å; L1036-I1067 HydrophobicContact CD2-CG1 3.84Å; L1036-I1067 HydrophobicContact CD2-CG2 3.87Å; L1036-Y1090 HydrophobicContact CB-CD2 4.32Å; L1036-Y1090 HydrophobicContact CD1-CD1 3.72Å; L1036-Y1090 HydrophobicContact CD1-CD2 3.84Å; L1036-Y1090 HydrophobicContact CD1-CE1 4.2Å; L1036-Y1090 HydrophobicContact CD1-CE2 4.3Å; L1036-Y1090 HydrophobicContact CD1-CG 3.51Å
1037	A	97.6	Very high	96.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.4	-44.9	170.5	0	0	0	0	0	111	F992 M995 S996 N1033 S1034 S1040 A1041	F992-A1037 HydrophobicContact CD1-CB 4.26Å; F992-A1037 HydrophobicContact CD2-CB 3.73Å; F992-A1037 HydrophobicContact CE1-CB 4.29Å; F992-A1037 HydrophobicContact CE2-CB 3.8Å; F992-A1037 VanDerWaalsContact CE2-N 3.26Å; F992-A1037 HydrophobicContact CG-CB 3.99Å; F992-A1037 HydrophobicContact CZ-CB 4.09Å; M995-A1037 HydrophobicContact CB-CB 4.49Å; M995-A1037 HydrophobicContact CG-CB 4.47Å; M995-A1037 HydrophobicContact SD-CB 3.89Å; S996-A1037 WeakPolarHBondContact CB-O 3.42Å; S996-A1037 PolarHBondContact OG-O 2.85Å; N1033-A1037 PolarHBondContact O-N 3.38Å; S1034-A1037 PolarHBondContact O-N 3.36Å; A1037-S1040 PolarHBondContact O-OG 3.49Å; A1037-A1041 PolarHBondContact O-N 2.93Å
1038	I	98.4	Very high	96.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-71.5	-45.3	174.9	-59.6	173.6	0	0	0	110.9	L954 V999 F1019 I1022 M1023 L1026 S1034 L1036 S1040 A1041 L1042	L954-I1038 HydrophobicContact CD1-CD1 4.04Å; V999-I1038 HydrophobicContact CG1-CG2 4.49Å; V999-I1038 HydrophobicContact CG2-CG1 4.27Å; F1019-I1038 HydrophobicContact CB-CG2 3.85Å; F1019-I1038 HydrophobicContact CD1-CD1 4.32Å; F1019-I1038 HydrophobicContact CD1-CG2 4.03Å; F1019-I1038 HydrophobicContact CG-CG2 4.21Å; I1022-I1038 HydrophobicContact CG2-CD1 3.78Å; M1023-I1038 HydrophobicContact CG-CB 3.92Å; M1023-I1038 HydrophobicContact CG-CD1 4.35Å; M1023-I1038 HydrophobicContact CG-CG2 3.66Å; M1023-I1038 HydrophobicContact SD-CB 4.16Å; M1023-I1038 HydrophobicContact SD-CG2 3.6Å; M1023-I1038 VanDerWaalsContact SD-CG2 3.6Å; L1026-I1038 HydrophobicContact CD1-CD1 3.6Å; S1034-I1038 VanDerWaalsContact O-CG1 3.31Å; S1034-I1038 WeakPolarHBondContact O-CG1 3.3Å; S1034-I1038 PolarHBondContact O-N 2.84Å; L1036-I1038 VanDerWaalsContact C-N 3.35Å; I1038-S1040 PolarHBondContact O-N 2.93Å; I1038-A1041 WeakPolarHBondContact O-CA 3.5Å; I1038-A1041 VanDerWaalsContact O-CB 3.27Å; I1038-A1041 WeakPolarHBondContact O-CB 3.29Å; I1038-A1041 PolarHBondContact O-N 3.08Å; I1038-L1042 HydrophobicContact CG2-CD1 4.28Å; I1038-L1042 HydrophobicContact CG2-CG 4.21Å; I1038-L1042 WeakPolarHBondContact O-CG 3.47Å; I1038-L1042 PolarHBondContact O-N 2.66Å
1039	L	96.4	Very high	96.3	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.031	9%	0.09	C	C	.	.	H	α-helix	trans	-59.1	-46.3	179.7	179.8	54.1	0	0	0	111.9	M1023 Y1035 L1036 A1041 L1042 D1043 L1060 I1067	M1023-L1039 HydrophobicContact CE-CB 3.73Å; M1023-L1039 HydrophobicContact CE-CD1 4.1Å; M1023-L1039 HydrophobicContact CE-CG 4.33Å; Y1035-L1039 HydrophobicContact CE1-CD2 4.3Å; Y1035-L1039 WeakPolarHBondContact O-CB 3.24Å; Y1035-L1039 PolarHBondContact O-N 2.85Å; L1036-L1039 HydrophobicContact CD2-CB 4.41Å; L1036-L1039 HydrophobicContact CD2-CD2 3.87Å; L1036-L1039 PolarHBondContact O-N 3.11Å; L1039-A1041 PolarHBondContact O-N 2.9Å; L1039-L1042 PolarHBondContact O-N 2.97Å; L1039-L1042 VanDerWaalsContact O-N 3.15Å; L1039-D1043 WeakPolarHBondContact O-CB 3.36Å; L1039-D1043 PolarHBondContact O-N 3.09Å; L1039-L1060 HydrophobicContact CD1-CD1 3.95Å; L1039-I1067 HydrophobicContact CD2-CG2 3.62Å
1040	S	95	Very high	96	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.007	8%	0.084	C	C	.	.	H	α-helix	trans	-70.6	-9.6	174.8	63.7	0	0	0	0	114.2	S996 R1000 L1036 A1037 I1038 S1044	S996-S1040 PolarHBondContact OG-OG 3.5Å; R1000-S1040 PolarHBondContact NE-O 3.04Å; R1000-S1040 PolarHBondContact NH2-O 3.23Å; L1036-S1040 VanDerWaalsContact O-CB 3.29Å; L1036-S1040 WeakPolarHBondContact O-CB 3.43Å; L1036-S1040 PolarHBondContact O-N 3.29Å; L1036-S1040 PolarHBondContact O-OG 2.77Å; A1037-S1040 PolarHBondContact O-OG 3.49Å; I1038-S1040 PolarHBondContact O-N 2.93Å; S1040-S1044 WeakPolarHBondContact O-CB 3.42Å
1041	A	96.9	Very high	95.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-80.7	-50.5	163.9	0	0	0	0	0	111.1	S996 V999 R1000 A1037 I1038 L1039 D1043 S1044	S996-A1041 WeakPolarHBondContact O-CB 3.46Å; S996-A1041 PolarHBondContact OG-N 3.31Å; V999-A1041 HydrophobicContact CB-CB 3.58Å; V999-A1041 HydrophobicContact CG1-CB 3.44Å; V999-A1041 VanDerWaalsContact CG1-CB 3.44Å; R1000-A1041 HydrophobicContact CG-CB 3.83Å; A1037-A1041 PolarHBondContact O-N 2.93Å; I1038-A1041 WeakPolarHBondContact O-CA 3.5Å; I1038-A1041 VanDerWaalsContact O-CB 3.27Å; I1038-A1041 WeakPolarHBondContact O-CB 3.29Å; I1038-A1041 PolarHBondContact O-N 3.08Å; L1039-A1041 PolarHBondContact O-N 2.9Å; A1041-D1043 PolarHBondContact O-N 2.95Å; A1041-S1044 VanDerWaalsContact O-CB 3.24Å; A1041-S1044 WeakPolarHBondContact O-CB 3.36Å; A1041-S1044 PolarHBondContact O-N 3.47Å; A1041-S1044 PolarHBondContact O-OG 3.46Å
1042	L	96.4	Very high	95.4	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-65.1	-37.5	-177.4	-58.8	-170.1	0	0	0	112.6	V999 I1003 L1016 F1019 I1020 M1023 I1038 L1039 S1044 I1047 L1060	V999-L1042 HydrophobicContact CG1-CD2 4.14Å; I1003-L1042 HydrophobicContact CD1-CD2 3.39Å; L1016-L1042 HydrophobicContact CD1-CD2 4.03Å; L1016-L1042 HydrophobicContact CG-CD1 4.27Å; L1016-L1042 HydrophobicContact CG-CD2 3.94Å; F1019-L1042 HydrophobicContact CB-CD1 4.14Å; F1019-L1042 HydrophobicContact CB-CD2 4.16Å; I1020-L1042 HydrophobicContact CG1-CD1 4.04Å; M1023-L1042 HydrophobicContact SD-CD1 3.92Å; I1038-L1042 HydrophobicContact CG2-CD1 4.28Å; I1038-L1042 HydrophobicContact CG2-CG 4.21Å; I1038-L1042 WeakPolarHBondContact O-CG 3.47Å; I1038-L1042 PolarHBondContact O-N 2.66Å; L1039-L1042 PolarHBondContact O-N 2.97Å; L1039-L1042 VanDerWaalsContact O-N 3.15Å; L1042-S1044 VanDerWaalsContact C-N 3.33Å; L1042-I1047 WeakPolarHBondContact O-CG2 3.22Å; L1042-L1060 HydrophobicContact CB-CD1 4.17Å; L1042-L1060 HydrophobicContact CB-CD2 4.05Å; L1042-L1060 HydrophobicContact CD1-CD1 3.76Å
1043	D	92.6	Very high	95.2	Very high	43 Å²	43	29.7 Å²	29.7	23%	0.23	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	0.7	178.3	-166.3	40.8	0	0	0	113.6	Q540 L1039 A1041 R1048	Q540-D1043 PolarHBondContact NE2-OD2 3.06Å; Q540-D1043 PolarHBondContact OE1-O 2.94Å; L1039-D1043 WeakPolarHBondContact O-CB 3.36Å; L1039-D1043 PolarHBondContact O-N 3.09Å; A1041-D1043 PolarHBondContact O-N 2.95Å; D1043-R1048 PolarHBondContact O-NH1 2.72Å; D1043-R1048 WeakPolarHBondContact OD1-CD 3.33Å; D1043-R1048 IonicContact OD1-CZ 3.4Å; D1043-R1048 IonicContact OD1-NE 2.69Å; D1043-R1048 IonicContact OD1-NH1 2.79Å; D1043-R1048 PolarHBondContact OD1-NH1 3.11Å; D1043-R1048 IonicContact OD2-NH1 3.71Å; D1043-R1048 PolarHBondContact OD2-NH1 3.31Å
1044	S	94.6	Very high	94.8	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.028	17%	0.17	C	C	.	.	S	Bend	trans	-59.8	146.5	178	69.4	0	0	0	0	112.4	S1040 A1041 L1042 P1046 I1047 R1048	S1040-S1044 WeakPolarHBondContact O-CB 3.42Å; A1041-S1044 VanDerWaalsContact O-CB 3.24Å; A1041-S1044 WeakPolarHBondContact O-CB 3.36Å; A1041-S1044 PolarHBondContact O-N 3.47Å; A1041-S1044 PolarHBondContact O-OG 3.46Å; L1042-S1044 VanDerWaalsContact C-N 3.33Å; S1044-P1046 VanDerWaalsContact C-CD 3.42Å; S1044-P1046 VanDerWaalsContact C-N 3.32Å; S1044-I1047 PolarHBondContact O-N 3.4Å; S1044-R1048 PolarHBondContact O-N 3.22Å
1045	A	94	Very high	94.3	Very high	47 Å²	47	44.1 Å²	44.1	39%	0.388	21%	0.205	S	C	.	.	H	α-helix	trans	-54.6	-34.5	-177.3	0	0	0	0	0	115.3	I1047 R1049 W1161	A1045-I1047 VanDerWaalsContact C-N 3.32Å; A1045-I1047 PolarHBondContact O-N 3.05Å; A1045-R1049 VanDerWaalsContact O-CD 3.27Å; A1045-R1049 WeakPolarHBondContact O-CD 3Å; A1045-R1049 WeakPolarHBondContact O-CG 3.32Å; A1045-W1161 HydrophobicContact CB-CZ3 4.23Å
1046	P	94.8	Very high	93.9	Very high	8 Å²	8	44.3 Å²	44.3	5%	0.052	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-28.1	171.8	-23.7	35.1	0	0	0	114.9	I1004 S1044 L1160 W1161 S1164	I1004-P1046 HydrophobicContact CD1-CB 3.73Å; S1044-P1046 VanDerWaalsContact C-CD 3.42Å; S1044-P1046 VanDerWaalsContact C-N 3.32Å; P1046-L1160 HydrophobicContact CB-CB 4.27Å; P1046-L1160 HydrophobicContact CG-CB 4.06Å; P1046-W1161 HydrophobicContact CG-CE3 4.3Å; P1046-S1164 WeakPolarHBondContact O-CB 3.29Å; P1046-S1164 PolarHBondContact O-OG 3.35Å
1047	I	95.8	Very high	93.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-97.7	-51.7	-175.7	-66.4	-171.3	0	0	0	111.4	R1000 I1003 L1016 L1042 S1044 A1045 R1049 L1050 W1052	R1000-I1047 HydrophobicContact CB-CD1 4.39Å; R1000-I1047 HydrophobicContact CG-CD1 4.4Å; I1003-I1047 HydrophobicContact CB-CD1 3.96Å; I1003-I1047 HydrophobicContact CD1-CD1 3.85Å; I1003-I1047 HydrophobicContact CG2-CD1 4.02Å; L1016-I1047 HydrophobicContact CD1-CG2 3.89Å; L1042-I1047 WeakPolarHBondContact O-CG2 3.22Å; S1044-I1047 PolarHBondContact O-N 3.4Å; A1045-I1047 VanDerWaalsContact C-N 3.32Å; A1045-I1047 PolarHBondContact O-N 3.05Å; I1047-R1049 PolarHBondContact O-N 3.45Å; I1047-L1050 WeakPolarHBondContact O-CB 3.49Å; I1047-L1050 PolarHBondContact O-N 2.96Å; I1047-W1052 HydrophobicContact CG2-CH2 4.18Å; I1047-W1052 HydrophobicContact CG2-CZ2 3.49Å; I1047-W1052 VanDerWaalsContact CG2-CZ2 3.49Å; I1047-W1052 WeakPolarHBondContact O-CZ2 3.35Å; I1047-W1052 PolarHBondContact O-NE1 2.91Å
1048	R	93.2	Very high	93.2	Very high	124 Å²	124	51 Å²	51	47%	0.468	24%	0.244	S	C	.	.	H	α-helix	trans	-51.1	-33	179.2	172	170.4	54	-140.3	-0.8	113.5	D1043 S1044 L1050	D1043-R1048 PolarHBondContact O-NH1 2.72Å; D1043-R1048 WeakPolarHBondContact OD1-CD 3.33Å; D1043-R1048 IonicContact OD1-CZ 3.4Å; D1043-R1048 IonicContact OD1-NE 2.69Å; D1043-R1048 IonicContact OD1-NH1 2.79Å; D1043-R1048 PolarHBondContact OD1-NH1 3.11Å; D1043-R1048 IonicContact OD2-NH1 3.71Å; D1043-R1048 PolarHBondContact OD2-NH1 3.31Å; S1044-R1048 PolarHBondContact O-N 3.22Å; R1048-L1050 VanDerWaalsContact C-N 3.34Å; R1048-L1050 PolarHBondContact O-N 3.44Å
1049	R	93.9	Very high	92.6	Very high	54 Å²	54	52.1 Å²	52.1	20%	0.204	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-10.6	-178.2	71.4	179.8	-70.5	-74.1	-6.4	115.7	A1045 I1047 S1164 K1168	A1045-R1049 VanDerWaalsContact O-CD 3.27Å; A1045-R1049 WeakPolarHBondContact O-CD 3Å; A1045-R1049 WeakPolarHBondContact O-CG 3.32Å; I1047-R1049 PolarHBondContact O-N 3.45Å; R1049-S1164 VanDerWaalsContact CD-OG 3.23Å; R1049-S1164 WeakPolarHBondContact CD-OG 3.43Å; R1049-S1164 VanDerWaalsContact CG-OG 3.31Å; R1049-S1164 WeakPolarHBondContact CG-OG 3.49Å; R1049-S1164 PolarHBondContact NH1-O 2.87Å; R1049-S1164 PolarHBondContact NH1-OG 3.37Å; R1049-K1168 PolarHBondContact NH1-O 3.37Å; R1049-K1168 PolarHBondContact NH2-O 3.06Å; R1049-K1168 VanDerWaalsContact O-CD 3.29Å; R1049-K1168 WeakPolarHBondContact O-CD 3.36Å; R1049-K1168 WeakPolarHBondContact O-CE 3.19Å; R1049-K1168 PolarHBondContact O-NZ 3.46Å
1050	L	93.3	Very high	92.3	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.058	26%	0.259	C	S	.	.	S	Bend	trans	-71.2	-173	178	-59.1	-175	0	0	0	110.7	I1047 R1048 W1052 I1167 K1168	I1047-L1050 WeakPolarHBondContact O-CB 3.49Å; I1047-L1050 PolarHBondContact O-N 2.96Å; R1048-L1050 VanDerWaalsContact C-N 3.34Å; R1048-L1050 PolarHBondContact O-N 3.44Å; L1050-W1052 HydrophobicContact CB-CZ2 3.77Å; L1050-W1052 HydrophobicContact CD1-CH2 4.2Å; L1050-W1052 HydrophobicContact CD1-CZ2 3.84Å; L1050-W1052 HydrophobicContact CG-CZ2 4.24Å; L1050-I1167 HydrophobicContact CD2-CB 4.3Å; L1050-I1167 HydrophobicContact CD2-CG2 3.86Å; L1050-K1168 HydrophobicContact CD2-CB 4.06Å; L1050-K1168 PolarHBondContact O-NZ 2.73Å
1051	E	89	Confident	92	Very high	149 Å²	149	59 Å²	59	70%	0.696	29%	0.287	S	S	*	.			trans	-112.8	126	173.4	-90.8	143.3	-126.7	0	0	108.2	K1168	E1051-K1168 WeakPolarHBondContact OE1-CD 3.41Å; E1051-K1168 WeakPolarHBondContact OE1-CE 3.3Å; E1051-K1168 IonicContact OE1-NZ 2.91Å; E1051-K1168 PolarHBondContact OE1-NZ 3.34Å
1052	W	93.8	Very high	91.6	Very high	56 Å²	56	63.7 Å²	63.7	21%	0.212	31%	0.309	C	S	.	.			trans	-123.6	160	-173.1	-56.3	108.3	0	0	0	109.5	I1003 R1012 L1016 I1047 L1050	I1003-W1052 HydrophobicContact CG2-CH2 3.93Å; R1012-W1052 HydrophobicContact CB-CH2 4.02Å; R1012-W1052 HydrophobicContact CB-CZ3 3.86Å; L1016-W1052 HydrophobicContact CB-CZ3 4.16Å; L1016-W1052 HydrophobicContact CD1-CD2 4.27Å; L1016-W1052 HydrophobicContact CD1-CE3 4.14Å; L1016-W1052 HydrophobicContact CD1-CH2 3.75Å; L1016-W1052 HydrophobicContact CD1-CZ2 3.89Å; L1016-W1052 HydrophobicContact CD1-CZ3 3.87Å; I1047-W1052 HydrophobicContact CG2-CH2 4.18Å; I1047-W1052 HydrophobicContact CG2-CZ2 3.49Å; I1047-W1052 VanDerWaalsContact CG2-CZ2 3.49Å; I1047-W1052 WeakPolarHBondContact O-CZ2 3.35Å; I1047-W1052 PolarHBondContact O-NE1 2.91Å; L1050-W1052 HydrophobicContact CB-CZ2 3.77Å; L1050-W1052 HydrophobicContact CD1-CH2 4.2Å; L1050-W1052 HydrophobicContact CD1-CZ2 3.84Å; L1050-W1052 HydrophobicContact CG-CZ2 4.24Å
1053	Q	92.4	Very high	91.3	Very high	117 Å²	117	63.9 Å²	63.9	55%	0.547	31%	0.31	S	S	.	.			trans	-72.9	142.9	173.2	-62.3	-174.3	-7.5	0	0	110.8	E1013 Q1055 T1056 S1057	E1013-Q1053 HydrophobicContact CG-CG 4.31Å; E1013-Q1053 WeakPolarHBondContact OE1-CB 3.4Å; E1013-Q1053 PolarHBondContact OE1-N 2.84Å; E1013-Q1053 PolarHBondContact OE2-N 3.07Å; Q1053-Q1055 VanDerWaalsContact C-N 3.3Å; Q1053-Q1055 PolarHBondContact O-N 2.69Å; Q1053-T1056 WeakPolarHBondContact O-CA 3.49Å; Q1053-T1056 VanDerWaalsContact O-CB 3.3Å; Q1053-T1056 WeakPolarHBondContact O-CB 3.43Å; Q1053-T1056 PolarHBondContact O-N 3.03Å; Q1053-S1057 PolarHBondContact O-N 2.94Å; Q1053-S1057 VanDerWaalsContact O-N 3.08Å; Q1053-S1057 PolarHBondContact O-OG 3.28Å
1054	K	89.4	Confident	91.1	Very high	146 Å²	146	63.9 Å²	63.9	64%	0.635	31%	0.313	S	S	*	.	H	α-helix	trans	-53.9	-46.4	-174.7	-170.4	-167.8	159.5	-160.1	0	112.3	T1056 S1057 E1058	K1054-T1056 PolarHBondContact O-N 2.88Å; K1054-S1057 WeakPolarHBondContact CA-OG 3.47Å; K1054-S1057 PolarHBondContact O-N 3.26Å; K1054-S1057 PolarHBondContact O-OG 2.65Å; K1054-E1058 WeakPolarHBondContact CE-OE1 3.16Å; K1054-E1058 WeakPolarHBondContact CE-OE2 3.3Å; K1054-E1058 IonicContact NZ-OE1 2.76Å; K1054-E1058 PolarHBondContact NZ-OE1 3.14Å; K1054-E1058 IonicContact NZ-OE2 3Å; K1054-E1058 WeakPolarHBondContact O-CG 3.49Å; K1054-E1058 PolarHBondContact O-N 3.03Å
1055	Q	89.3	Confident	90.8	Very high	157 Å²	157	67.6 Å²	67.6	73%	0.734	34%	0.335	S	S	*	.	H	α-helix	trans	-59.9	-33.4	177.4	-174.3	179.4	10.6	0	0	112.7	Q1053 G1059	Q1053-Q1055 VanDerWaalsContact C-N 3.3Å; Q1053-Q1055 PolarHBondContact O-N 2.69Å; Q1055-G1059 PolarHBondContact O-N 3.04Å
1056	T	89.6	Confident	90.5	Very high	3 Å²	3	65.8 Å²	65.8	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-73.4	-39.4	177.1	-51	0	0	0	0	111.6	E1013 L1016 L1017 I1020 Q1053 K1054 G1059 L1060	E1013-T1056 WeakPolarHBondContact OE1-CB 3.31Å; E1013-T1056 WeakPolarHBondContact OE1-CG2 3.39Å; E1013-T1056 PolarHBondContact OE1-OG1 3.07Å; L1016-T1056 HydrophobicContact CD2-CG2 3.33Å; L1017-T1056 HydrophobicContact CD2-CG2 3.78Å; L1017-T1056 HydrophobicContact CG-CG2 3.91Å; I1020-T1056 HydrophobicContact CD1-CG2 4.23Å; Q1053-T1056 WeakPolarHBondContact O-CA 3.49Å; Q1053-T1056 VanDerWaalsContact O-CB 3.3Å; Q1053-T1056 WeakPolarHBondContact O-CB 3.43Å; Q1053-T1056 PolarHBondContact O-N 3.03Å; K1054-T1056 PolarHBondContact O-N 2.88Å; T1056-G1059 CarbonylContact O-C 3.5Å; T1056-G1059 PolarHBondContact O-N 3.46Å; T1056-L1060 PolarHBondContact O-N 3.13Å
1057	S	89	Confident	90.2	Very high	55 Å²	55	66.4 Å²	66.4	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-66.5	-45.5	173.3	40.9	0	0	0	0	112.3	Q1053 K1054 G1059 L1060 E1061	Q1053-S1057 PolarHBondContact O-N 2.94Å; Q1053-S1057 VanDerWaalsContact O-N 3.08Å; Q1053-S1057 PolarHBondContact O-OG 3.28Å; K1054-S1057 WeakPolarHBondContact CA-OG 3.47Å; K1054-S1057 PolarHBondContact O-N 3.26Å; K1054-S1057 PolarHBondContact O-OG 2.65Å; S1057-G1059 VanDerWaalsContact C-N 3.28Å; S1057-G1059 PolarHBondContact O-N 2.86Å; S1057-L1060 PolarHBondContact O-N 3.11Å; S1057-E1061 PolarHBondContact O-N 3.43Å
1058	E	88.8	Confident	89.8	Confident	89 Å²	89	70 Å²	70	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-39.5	174.1	-71.1	171.1	138.2	0	0	110.8	K1054 L1060 E1061 E1062	K1054-E1058 WeakPolarHBondContact CE-OE1 3.16Å; K1054-E1058 WeakPolarHBondContact CE-OE2 3.3Å; K1054-E1058 IonicContact NZ-OE1 2.76Å; K1054-E1058 PolarHBondContact NZ-OE1 3.14Å; K1054-E1058 IonicContact NZ-OE2 3Å; K1054-E1058 WeakPolarHBondContact O-CG 3.49Å; K1054-E1058 PolarHBondContact O-N 3.03Å; E1058-L1060 VanDerWaalsContact C-N 3.27Å; E1058-L1060 PolarHBondContact O-N 2.92Å; E1058-E1061 PolarHBondContact O-N 2.88Å; E1058-E1062 PolarHBondContact O-N 3.35Å
1059	G	86.7	Confident	89.4	Confident	23 Å²	23	66.1 Å²	66.1	24%	0.237	33%	0.333	C	S	.	.	H	α-helix	trans	-71.4	-12.2	175	0	0	0	0	0	115.4	Q1055 T1056 S1057 Y1063	Q1055-G1059 PolarHBondContact O-N 3.04Å; T1056-G1059 CarbonylContact O-C 3.5Å; T1056-G1059 PolarHBondContact O-N 3.46Å; S1057-G1059 VanDerWaalsContact C-N 3.28Å; S1057-G1059 PolarHBondContact O-N 2.86Å; G1059-Y1063 WeakPolarHBondContact O-CD2 3.33Å; G1059-Y1063 VanDerWaalsContact O-CE2 3.23Å; G1059-Y1063 WeakPolarHBondContact O-CE2 3.31Å
1060	L	90.7	Very high	88.9	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-91.6	-39.6	169	-179	59.1	0	0	0	110.8	I1020 L1039 L1042 T1056 S1057 E1058 E1062 Y1063 C1064	I1020-L1060 HydrophobicContact CD1-CB 4.04Å; I1020-L1060 HydrophobicContact CD1-CD1 4.46Å; I1020-L1060 HydrophobicContact CG1-CD1 4.19Å; L1039-L1060 HydrophobicContact CD1-CD1 3.95Å; L1042-L1060 HydrophobicContact CB-CD1 4.17Å; L1042-L1060 HydrophobicContact CB-CD2 4.05Å; L1042-L1060 HydrophobicContact CD1-CD1 3.76Å; T1056-L1060 PolarHBondContact O-N 3.13Å; S1057-L1060 PolarHBondContact O-N 3.11Å; E1058-L1060 VanDerWaalsContact C-N 3.27Å; E1058-L1060 PolarHBondContact O-N 2.92Å; L1060-E1062 VanDerWaalsContact C-N 3.27Å; L1060-E1062 PolarHBondContact O-N 3.31Å; L1060-Y1063 WeakPolarHBondContact O-CA 3.48Å; L1060-Y1063 PolarHBondContact O-N 2.9Å; L1060-C1064 PolarHBondContact O-N 3.18Å
1061	E	89	Confident	88.6	Confident	129 Å²	129	70.9 Å²	70.9	60%	0.603	38%	0.375	S	S	*	.	H	α-helix	trans	-56.5	-37.4	179.5	-167.1	170.2	-166.2	0	0	112.3	S1057 E1058 Y1063 C1064 T1065	S1057-E1061 PolarHBondContact O-N 3.43Å; E1058-E1061 PolarHBondContact O-N 2.88Å; E1061-Y1063 PolarHBondContact O-N 3.39Å; E1061-Y1063 VanDerWaalsContact O-N 3.14Å; E1061-C1064 WeakPolarHBondContact O-CB 3.48Å; E1061-C1064 PolarHBondContact O-N 3.3Å; E1061-C1064 VanDerWaalsContact O-N 3.13Å; E1061-T1065 WeakPolarHBondContact O-CG2 3.49Å; E1061-T1065 PolarHBondContact O-N 3.27Å
1062	E	88.2	Confident	88.5	Confident	99 Å²	99	66.7 Å²	66.7	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-48	-40.6	169.8	-170.5	-163.7	174.6	0	0	112.3	E1058 L1060 T1065	E1058-E1062 PolarHBondContact O-N 3.35Å; L1060-E1062 VanDerWaalsContact C-N 3.27Å; L1060-E1062 PolarHBondContact O-N 3.31Å; E1062-T1065 PolarHBondContact O-OG1 2.9Å
1063	Y	89	Confident	88.4	Confident	6 Å²	6	65.5 Å²	65.5	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-88.4	-23.6	-175.6	-61.8	-80.3	0	0	0	113.1	I1020 M1023 K1024 Y1035 G1059 L1060 E1061 T1065	I1020-Y1063 HydrophobicContact CG2-CD2 4.07Å; I1020-Y1063 HydrophobicContact CG2-CE2 3.8Å; M1023-Y1063 HydrophobicContact CE-CG 4.3Å; K1024-Y1063 HydrophobicContact CB-CE1 4.27Å; K1024-Y1063 HydrophobicContact CG-CE1 4.43Å; K1024-Y1063 PolarHBondContact NZ-OH 3.5Å; Y1035-Y1063 AromaticContact CE2-CD1 3.86Å; Y1035-Y1063 HydrophobicContact CE2-CD1 3.86Å; Y1035-Y1063 VanDerWaalsContact OH-CA 3.3Å; Y1035-Y1063 WeakPolarHBondContact OH-CA 3.49Å; Y1035-Y1063 VanDerWaalsContact OH-CB 3.28Å; Y1035-Y1063 WeakPolarHBondContact OH-CB 3.38Å; Y1035-Y1063 PolarHBondContact OH-O 2.85Å; G1059-Y1063 WeakPolarHBondContact O-CD2 3.33Å; G1059-Y1063 VanDerWaalsContact O-CE2 3.23Å; G1059-Y1063 WeakPolarHBondContact O-CE2 3.31Å; L1060-Y1063 WeakPolarHBondContact O-CA 3.48Å; L1060-Y1063 PolarHBondContact O-N 2.9Å; E1061-Y1063 PolarHBondContact O-N 3.39Å; E1061-Y1063 VanDerWaalsContact O-N 3.14Å; Y1063-T1065 VanDerWaalsContact C-N 3.3Å; Y1063-T1065 PolarHBondContact O-N 2.89Å
1064	C	88.3	Confident	88.4	Confident	42 Å²	42	68.6 Å²	68.6	28%	0.284	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-38.1	170.2	-60.8	0	0	0	0	111.8	L1060 E1061 L1066 I1067 D1068	L1060-C1064 PolarHBondContact O-N 3.18Å; E1061-C1064 WeakPolarHBondContact O-CB 3.48Å; E1061-C1064 PolarHBondContact O-N 3.3Å; E1061-C1064 VanDerWaalsContact O-N 3.13Å; C1064-L1066 PolarHBondContact O-N 2.97Å; C1064-I1067 PolarHBondContact O-N 3.03Å; C1064-D1068 PolarHBondContact O-N 3.23Å
1065	T	87.8	Confident	88.5	Confident	82 Å²	82	63.8 Å²	63.8	50%	0.503	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-53.2	-26	-177	65.2	0	0	0	0	115.3	E1061 E1062 Y1063	E1061-T1065 WeakPolarHBondContact O-CG2 3.49Å; E1061-T1065 PolarHBondContact O-N 3.27Å; E1062-T1065 PolarHBondContact O-OG1 2.9Å; Y1063-T1065 VanDerWaalsContact C-N 3.3Å; Y1063-T1065 PolarHBondContact O-N 2.89Å
1066	L	88.4	Confident	88.8	Confident	9 Å²	9	56.5 Å²	56.5	5%	0.047	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-69.6	-34	179.4	-179.1	61	0	0	0	112.3	F1032 Y1035 C1064 Y1076 A1079	F1032-L1066 HydrophobicContact CD1-CD2 4Å; F1032-L1066 HydrophobicContact CE1-CD2 3.93Å; Y1035-L1066 HydrophobicContact CD1-CD2 4.44Å; Y1035-L1066 HydrophobicContact CE1-CB 4.49Å; Y1035-L1066 HydrophobicContact CE1-CD2 3.8Å; C1064-L1066 PolarHBondContact O-N 2.97Å; L1066-Y1076 WeakPolarHBondContact O-CA 3.3Å; L1066-Y1076 VanDerWaalsContact O-CB 3.29Å; L1066-Y1076 WeakPolarHBondContact O-CB 3.39Å; L1066-Y1076 PolarHBondContact O-N 3.12Å; L1066-A1079 HydrophobicContact CD1-CB 4.04Å
1067	I	88.1	Confident	89	Confident	21 Å²	21	60 Å²	60	11%	0.108	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-112.5	19.9	-174.9	-156.1	61.3	0	0	0	112.4	L1036 L1039 C1064 S1069 F1073 Y1076 L1093	L1036-I1067 HydrophobicContact CD1-CD1 3.76Å; L1036-I1067 HydrophobicContact CD1-CG1 3.94Å; L1036-I1067 HydrophobicContact CD2-CB 3.85Å; L1036-I1067 HydrophobicContact CD2-CD1 4.4Å; L1036-I1067 HydrophobicContact CD2-CG1 3.84Å; L1036-I1067 HydrophobicContact CD2-CG2 3.87Å; L1039-I1067 HydrophobicContact CD2-CG2 3.62Å; C1064-I1067 PolarHBondContact O-N 3.03Å; I1067-S1069 PolarHBondContact O-N 3.15Å; I1067-F1073 HydrophobicContact CD1-CD1 3.79Å; I1067-F1073 HydrophobicContact CD1-CE1 4.36Å; I1067-F1073 HydrophobicContact CG1-CD1 4Å; I1067-F1073 HydrophobicContact CG1-CE1 4.19Å; I1067-F1073 WeakPolarHBondContact O-CD1 3.3Å; I1067-F1073 WeakPolarHBondContact O-CE1 3.21Å; I1067-Y1076 HydrophobicContact CD1-CD1 4.48Å; I1067-Y1076 HydrophobicContact CD1-CD2 4.34Å; I1067-Y1076 HydrophobicContact CD1-CG 3.99Å; I1067-L1093 HydrophobicContact CD1-CD1 4.07Å
1068	D	87.8	Confident	89.1	Confident	77 Å²	77	59.5 Å²	59.5	41%	0.412	33%	0.331	S	S	.	.			trans	-48.4	120.4	167.4	171.9	18.5	0	0	0	110.1	C1064 S1070 F1073	C1064-D1068 PolarHBondContact O-N 3.23Å; D1068-S1070 PolarHBondContact O-N 2.99Å; D1068-S1070 WeakPolarHBondContact OD1-CB 3.45Å; D1068-S1070 PolarHBondContact OD1-N 3.02Å; D1068-S1070 PolarHBondContact OD1-OG 3.33Å; D1068-S1070 WeakPolarHBondContact OD2-CB 3.5Å; D1068-S1070 PolarHBondContact OD2-OG 2.96Å; D1068-F1073 WeakPolarHBondContact O-CA 3.48Å
1069	S	85.1	Confident	89.3	Confident	41 Å²	41	56.6 Å²	56.6	29%	0.287	32%	0.323	S	S	.	.			trans	-66.1	-19.5	-177.7	61.8	0	0	0	0	112.5	E538 I1067 S1071 S1072 F1073	E538-S1069 VanDerWaalsContact OE1-CB 3.27Å; E538-S1069 WeakPolarHBondContact OE1-CB 3.39Å; E538-S1069 PolarHBondContact OE1-OG 2.72Å; I1067-S1069 PolarHBondContact O-N 3.15Å; S1069-S1071 PolarHBondContact O-N 3.49Å; S1069-S1072 WeakPolarHBondContact O-CA 3.1Å; S1069-S1072 PolarHBondContact O-N 3.25Å; S1069-F1073 PolarHBondContact O-N 3.47Å; S1069-F1073 VanDerWaalsContact O-N 3.14Å
1070	S	84.3	Confident	89.6	Confident	67 Å²	67	56.4 Å²	56.4	47%	0.469	32%	0.316	S	S	.	.	H	α-helix	trans	-48.7	131.3	-179.7	-59.5	0	0	0	0	112.6	D1068 S1072	D1068-S1070 PolarHBondContact O-N 2.99Å; D1068-S1070 WeakPolarHBondContact OD1-CB 3.45Å; D1068-S1070 PolarHBondContact OD1-N 3.02Å; D1068-S1070 PolarHBondContact OD1-OG 3.33Å; D1068-S1070 WeakPolarHBondContact OD2-CB 3.5Å; D1068-S1070 PolarHBondContact OD2-OG 2.96Å; S1070-S1072 VanDerWaalsContact C-N 3.26Å; S1070-S1072 PolarHBondContact O-N 3.37Å
1071	S	85.8	Confident	89.7	Confident	98 Å²	98	59 Å²	59	69%	0.685	34%	0.34	S	S	*	.	H	α-helix	trans	56.4	34.6	-175.2	-51.4	0	0	0	0	114.2	S1069	S1069-S1071 PolarHBondContact O-N 3.49Å
1072	S	87.1	Confident	89.9	Confident	62 Å²	62	60.5 Å²	60.5	43%	0.434	35%	0.347	S	S	.	.	H	α-helix	trans	60	62.5	-177.6	-168.7	0	0	0	0	112.7	S1069 S1070 R1074 R1077	S1069-S1072 WeakPolarHBondContact O-CA 3.1Å; S1069-S1072 PolarHBondContact O-N 3.25Å; S1070-S1072 VanDerWaalsContact C-N 3.26Å; S1070-S1072 PolarHBondContact O-N 3.37Å; S1072-R1074 VanDerWaalsContact C-N 3.25Å; S1072-R1074 PolarHBondContact O-N 3.48Å; S1072-R1077 VanDerWaalsContact O-CD 3.26Å; S1072-R1077 WeakPolarHBondContact O-CD 3.35Å; S1072-R1077 PolarHBondContact O-NE 2.96Å
1073	F	92.1	Very high	90.2	Very high	30 Å²	30	56.6 Å²	56.6	13%	0.132	33%	0.33	C	S	.	.	H	α-helix	trans	57.4	34.9	174.7	-55.9	-82.9	0	0	0	114	F544 I1067 D1068 S1069 A1075 Y1076 R1077 L1093	F544-F1073 HydrophobicContact CZ-CZ 4.25Å; I1067-F1073 HydrophobicContact CD1-CD1 3.79Å; I1067-F1073 HydrophobicContact CD1-CE1 4.36Å; I1067-F1073 HydrophobicContact CG1-CD1 4Å; I1067-F1073 HydrophobicContact CG1-CE1 4.19Å; I1067-F1073 WeakPolarHBondContact O-CD1 3.3Å; I1067-F1073 WeakPolarHBondContact O-CE1 3.21Å; D1068-F1073 WeakPolarHBondContact O-CA 3.48Å; S1069-F1073 PolarHBondContact O-N 3.47Å; S1069-F1073 VanDerWaalsContact O-N 3.14Å; F1073-A1075 VanDerWaalsContact C-N 3.28Å; F1073-A1075 PolarHBondContact O-N 2.99Å; F1073-Y1076 PolarHBondContact O-N 3.35Å; F1073-R1077 WeakPolarHBondContact O-CG 3.36Å; F1073-R1077 PolarHBondContact O-N 2.94Å; F1073-L1093 HydrophobicContact CB-CD1 3.84Å; F1073-L1093 HydrophobicContact CB-CD2 4.42Å; F1073-L1093 HydrophobicContact CD1-CD1 4.38Å; F1073-L1093 HydrophobicContact CD2-CD1 4.29Å; F1073-L1093 HydrophobicContact CD2-CD2 3.37Å; F1073-L1093 HydrophobicContact CD2-CG 4.49Å; F1073-L1093 HydrophobicContact CE2-CD2 3.65Å; F1073-L1093 HydrophobicContact CG-CD1 3.91Å; F1073-L1093 HydrophobicContact CG-CD2 3.85Å; F1073-L1093 HydrophobicContact CZ-CD2 4.33Å
1074	R	92.7	Very high	90.4	Very high	182 Å²	182	63.8 Å²	63.8	69%	0.687	36%	0.364	S	S	*	.	H	α-helix	trans	-57.5	-37.3	-170.1	-176.1	178.8	176.9	-165.1	-1.2	113.4	S1072 R1077 A1078	S1072-R1074 VanDerWaalsContact C-N 3.25Å; S1072-R1074 PolarHBondContact O-N 3.48Å; R1074-R1077 PolarHBondContact O-N 3.48Å; R1074-A1078 WeakPolarHBondContact O-CB 3.35Å; R1074-A1078 PolarHBondContact O-N 3.07Å
1075	A	91.9	Very high	90.7	Very high	46 Å²	46	63.5 Å²	63.5	38%	0.38	36%	0.362	S	S	.	.	H	α-helix	trans	-63.7	-48.6	178.8	0	0	0	0	0	112	F1073 A1078 A1079	F1073-A1075 VanDerWaalsContact C-N 3.28Å; F1073-A1075 PolarHBondContact O-N 2.99Å; A1075-A1078 PolarHBondContact O-N 3.27Å; A1075-A1079 PolarHBondContact O-N 2.84Å; A1075-A1079 VanDerWaalsContact O-N 3.1Å
1076	Y	93.9	Very high	91.1	Very high	4 Å²	4	61.4 Å²	61.4	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-46.2	174.1	172.4	-101.2	0	0	0	111.9	F1032 L1066 I1067 F1073 A1078 A1079 L1080 Y1090 L1093	F1032-Y1076 HydrophobicContact CB-CE2 3.82Å; F1032-Y1076 HydrophobicContact CD1-CE2 4.17Å; F1032-Y1076 HydrophobicContact CD2-CE2 4.23Å; F1032-Y1076 AromaticContact CG-CE2 3.81Å; F1032-Y1076 HydrophobicContact CG-CE2 3.81Å; L1066-Y1076 WeakPolarHBondContact O-CA 3.3Å; L1066-Y1076 VanDerWaalsContact O-CB 3.29Å; L1066-Y1076 WeakPolarHBondContact O-CB 3.39Å; L1066-Y1076 PolarHBondContact O-N 3.12Å; I1067-Y1076 HydrophobicContact CD1-CD1 4.48Å; I1067-Y1076 HydrophobicContact CD1-CD2 4.34Å; I1067-Y1076 HydrophobicContact CD1-CG 3.99Å; F1073-Y1076 PolarHBondContact O-N 3.35Å; Y1076-A1078 VanDerWaalsContact C-N 3.33Å; Y1076-A1078 PolarHBondContact O-N 3.12Å; Y1076-A1079 PolarHBondContact O-N 3.37Å; Y1076-L1080 HydrophobicContact CE1-CD2 3.93Å; Y1076-L1080 WeakPolarHBondContact O-CB 3Å; Y1076-L1080 PolarHBondContact O-N 3.48Å; Y1076-Y1090 PolarHBondContact OH-N 3.08Å; Y1076-L1093 HydrophobicContact CD1-CD1 3.36Å; Y1076-L1093 HydrophobicContact CE1-CD1 3.6Å; Y1076-L1093 HydrophobicContact CG-CD1 4.26Å
1077	R	93.6	Very high	91.5	Very high	76 Å²	76	61 Å²	61	29%	0.287	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-39.8	-179.7	-68.7	178.6	-174	-82.4	6.4	112.5	S1072 F1073 R1074 L1080 A1081 D1097	S1072-R1077 VanDerWaalsContact O-CD 3.26Å; S1072-R1077 WeakPolarHBondContact O-CD 3.35Å; S1072-R1077 PolarHBondContact O-NE 2.96Å; F1073-R1077 WeakPolarHBondContact O-CG 3.36Å; F1073-R1077 PolarHBondContact O-N 2.94Å; R1074-R1077 PolarHBondContact O-N 3.48Å; R1077-L1080 PolarHBondContact O-N 2.91Å; R1077-A1081 WeakPolarHBondContact O-CB 3.33Å; R1077-A1081 PolarHBondContact O-N 2.88Å; R1077-A1081 VanDerWaalsContact O-N 3.07Å; R1077-D1097 IonicContact CZ-OD1 2.69Å; R1077-D1097 IonicContact CZ-OD2 3.66Å; R1077-D1097 IonicContact NH1-OD1 3.22Å; R1077-D1097 PolarHBondContact NH1-OD1 2.97Å; R1077-D1097 IonicContact NH1-OD2 3.55Å; R1077-D1097 PolarHBondContact NH1-OD2 2.89Å; R1077-D1097 IonicContact NH2-OD1 2.78Å; R1077-D1097 PolarHBondContact NH2-OD1 3.47Å; R1077-D1097 IonicContact NH2-OD2 3.56Å
1078	A	92.9	Very high	92	Very high	45 Å²	45	60 Å²	60	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-48.9	173.8	0	0	0	0	0	111.4	R1074 A1075 Y1076 L1080 A1081 E1082	R1074-A1078 WeakPolarHBondContact O-CB 3.35Å; R1074-A1078 PolarHBondContact O-N 3.07Å; A1075-A1078 PolarHBondContact O-N 3.27Å; Y1076-A1078 VanDerWaalsContact C-N 3.33Å; Y1076-A1078 PolarHBondContact O-N 3.12Å; A1078-L1080 VanDerWaalsContact C-N 3.29Å; A1078-L1080 PolarHBondContact O-N 3.23Å; A1078-A1081 PolarHBondContact O-N 2.53Å; A1078-A1081 VanDerWaalsContact O-N 3.13Å; A1078-E1082 WeakPolarHBondContact O-CG 3.21Å; A1078-E1082 PolarHBondContact O-N 3.25Å
1079	A	92.7	Very high	92.4	Very high	28 Å²	28	56.3 Å²	56.3	23%	0.231	32%	0.323	C	S	.	.	H	α-helix	trans	-59.1	-38.6	176.9	0	0	0	0	0	112.6	L1066 A1075 Y1076 E1082 V1083	L1066-A1079 HydrophobicContact CD1-CB 4.04Å; A1075-A1079 PolarHBondContact O-N 2.84Å; A1075-A1079 VanDerWaalsContact O-N 3.1Å; Y1076-A1079 PolarHBondContact O-N 3.37Å; A1079-E1082 PolarHBondContact O-N 3.17Å; A1079-V1083 VanDerWaalsContact O-CB 3.3Å; A1079-V1083 WeakPolarHBondContact O-CB 3.29Å; A1079-V1083 PolarHBondContact O-N 2.89Å
1080	L	93.1	Very high	92.9	Very high	18 Å²	18	54.5 Å²	54.5	9%	0.094	31%	0.31	C	S	.	.	H	α-helix	trans	-72.3	-26.6	178.3	-163.2	71.1	0	0	0	113.3	F1032 Y1076 R1077 A1078 V1083 P1089 F1131	F1032-L1080 HydrophobicContact CD2-CD1 4.08Å; F1032-L1080 HydrophobicContact CE2-CD1 4.14Å; Y1076-L1080 HydrophobicContact CE1-CD2 3.93Å; Y1076-L1080 WeakPolarHBondContact O-CB 3Å; Y1076-L1080 PolarHBondContact O-N 3.48Å; R1077-L1080 PolarHBondContact O-N 2.91Å; A1078-L1080 VanDerWaalsContact C-N 3.29Å; A1078-L1080 PolarHBondContact O-N 3.23Å; L1080-V1083 HydrophobicContact CD1-CG1 4.4Å; L1080-P1089 HydrophobicContact CD1-CB 4.07Å; L1080-P1089 HydrophobicContact CD2-CB 4.35Å; L1080-F1131 HydrophobicContact CD1-CE2 3.62Å; L1080-F1131 HydrophobicContact CD1-CZ 3.8Å; L1080-F1131 HydrophobicContact CD2-CE2 4.48Å; L1080-F1131 HydrophobicContact CG-CE2 3.91Å; L1080-F1131 HydrophobicContact CG-CZ 4.11Å
1081	A	92.2	Very high	93.4	Very high	76 Å²	76	51.4 Å²	51.4	63%	0.628	29%	0.288	S	S	*	.	H	α-helix	trans	-77	-37.6	173.1	0	0	0	0	0	112.2	R1077 A1078	R1077-A1081 WeakPolarHBondContact O-CB 3.33Å; R1077-A1081 PolarHBondContact O-N 2.88Å; R1077-A1081 VanDerWaalsContact O-N 3.07Å; A1078-A1081 PolarHBondContact O-N 2.53Å; A1078-A1081 VanDerWaalsContact O-N 3.13Å
1082	E	92.6	Very high	93.7	Very high	162 Å²	162	46.9 Å²	46.9	76%	0.757	26%	0.257	S	S	*	.	H	α-helix	trans	-80	-27.6	-178.7	-70.5	178.6	178.2	0	0	113.8	A1078 A1079	A1078-E1082 WeakPolarHBondContact O-CG 3.21Å; A1078-E1082 PolarHBondContact O-N 3.25Å; A1079-E1082 PolarHBondContact O-N 3.17Å
1083	V	94.8	Very high	93.9	Very high	17 Å²	17	44.1 Å²	44.1	10%	0.103	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-67.8	138.7	-175.4	72.8	0	0	0	0	112.7	N1030 F1032 A1079 L1080 C1087 R1130 F1131	N1030-V1083 HydrophobicContact CB-CG2 3.86Å; N1030-V1083 VanDerWaalsContact ND2-CG2 3.3Å; N1030-V1083 WeakPolarHBondContact ND2-CG2 3.29Å; N1030-V1083 WeakPolarHBondContact OD1-CG2 3.42Å; F1032-V1083 HydrophobicContact CE2-CG1 4.43Å; A1079-V1083 VanDerWaalsContact O-CB 3.3Å; A1079-V1083 WeakPolarHBondContact O-CB 3.29Å; A1079-V1083 PolarHBondContact O-N 2.89Å; L1080-V1083 HydrophobicContact CD1-CG1 4.4Å; V1083-C1087 HydrophobicContact CG1-CB 4.29Å; V1083-C1087 HydrophobicContact CG2-CB 4.42Å; V1083-R1130 VanDerWaalsContact O-CZ 3.29Å; V1083-R1130 PolarHBondContact O-NH1 2.87Å; V1083-R1130 PolarHBondContact O-NH2 2.85Å; V1083-F1131 HydrophobicContact CG1-CE1 3.81Å; V1083-F1131 HydrophobicContact CG1-CZ 3.71Å
1084	E	93.3	Very high	94	Very high	156 Å²	156	43.1 Å²	43.1	73%	0.729	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-92.4	148	170.5	-64.9	-165.7	137.3	0	0	111.3	N1030	N1030-E1084 PolarHBondContact ND2-O 3.47Å
1085	P	94.5	Very high	94.1	Very high	37 Å²	37	35 Å²	35	24%	0.24	20%	0.203	C	C	.	.	S	Bend	trans	-63.9	150.7	175	-20.4	33.7	0	0	0	112.5	R1130 F1131 V1134	P1085-R1130 HydrophobicContact CG-CG 3.97Å; P1085-F1131 HydrophobicContact CB-CD1 4.45Å; P1085-F1131 HydrophobicContact CG-CD1 4.09Å; P1085-V1134 HydrophobicContact CB-CB 3.6Å; P1085-V1134 HydrophobicContact CB-CG1 4.34Å; P1085-V1134 HydrophobicContact CB-CG2 3.71Å; P1085-V1134 HydrophobicContact CG-CG2 4.43Å
1086	P	96.4	Very high	94.1	Very high	38 Å²	38	35.2 Å²	35.2	25%	0.247	20%	0.196	C	C	.	.	S	Bend	cis	-76.8	149.4	3.8	33.1	-36.6	0	0	0	112.9	N1030 V1134 Y1136	N1030-P1086 WeakPolarHBondContact CB-O 3.42Å; N1030-P1086 PolarHBondContact ND2-O 3.16Å; P1086-V1134 HydrophobicContact CB-CG1 4.35Å; P1086-Y1136 HydrophobicContact CB-CD1 3.98Å; P1086-Y1136 HydrophobicContact CB-CD2 4.06Å; P1086-Y1136 HydrophobicContact CB-CE1 3.83Å; P1086-Y1136 HydrophobicContact CB-CE2 3.88Å; P1086-Y1136 HydrophobicContact CB-CG 4.1Å; P1086-Y1136 HydrophobicContact CG-CD1 3.85Å; P1086-Y1136 HydrophobicContact CG-CE1 3.78Å; P1086-Y1136 HydrophobicContact CG-CG 4.37Å
1087	C	97.5	Very high	94.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.			trans	-158.8	145.9	-179	165.4	0	0	0	0	108.8	N1030 V1083 F1131 Y1136	N1030-C1087 HydrophobicContact CB-CB 3.73Å; N1030-C1087 WeakPolarHBondContact O-CA 3.31Å; N1030-C1087 PolarHBondContact O-SG 2.84Å; V1083-C1087 HydrophobicContact CG1-CB 4.29Å; V1083-C1087 HydrophobicContact CG2-CB 4.42Å; C1087-F1131 HydrophobicContact CB-CD1 3.53Å; C1087-F1131 HydrophobicContact CB-CE1 3.6Å; C1087-F1131 HydrophobicContact CB-CG 4.14Å; C1087-F1131 HydrophobicContact CB-CZ 4.27Å; C1087-Y1136 VanDerWaalsContact CA-OH 3.25Å; C1087-Y1136 WeakPolarHBondContact CA-OH 3.37Å; C1087-Y1136 PolarHBondContact N-OH 2.96Å
1088	I	97.9	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-114.8	105.7	171.2	-46.9	-174.1	0	0	0	108	T955 D958 A959 F962 F988 N1030 N1031 F1032 N1033 Y1136	T955-I1088 HydrophobicContact CG2-CD1 4.03Å; D958-I1088 HydrophobicContact CB-CD1 3.43Å; D958-I1088 VanDerWaalsContact CB-CD1 3.43Å; D958-I1088 HydrophobicContact CB-CG2 4.46Å; A959-I1088 HydrophobicContact CB-CD1 3.98Å; F962-I1088 HydrophobicContact CB-CG2 4.22Å; F962-I1088 HydrophobicContact CD1-CG2 4.38Å; F962-I1088 HydrophobicContact CG-CG2 4.15Å; F988-I1088 HydrophobicContact CE2-CG2 4.3Å; F988-I1088 HydrophobicContact CZ-CG2 4.07Å; N1030-I1088 PolarHBondContact O-N 3.43Å; N1031-I1088 HydrophobicContact CB-CD1 4.47Å; F1032-I1088 WeakPolarHBondContact CB-O 3.48Å; F1032-I1088 PolarHBondContact N-O 2.97Å; N1033-I1088 HydrophobicContact CB-CG2 3.84Å; I1088-Y1136 HydrophobicContact CD1-CE2 3.86Å; I1088-Y1136 HydrophobicContact CG1-CE2 3.54Å
1089	P	96.4	Very high	94.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.			trans	-68.5	148.9	176.5	29.2	-34.6	0	0	0	111.1	F962 L1080 L1091 I1094 F1131	F962-P1089 HydrophobicContact CE2-CG 3.87Å; F962-P1089 HydrophobicContact CZ-CG 3.85Å; L1080-P1089 HydrophobicContact CD1-CB 4.07Å; L1080-P1089 HydrophobicContact CD2-CB 4.35Å; P1089-L1091 HydrophobicContact CB-CD2 4.48Å; P1089-L1091 HydrophobicContact CG-CD2 3.86Å; P1089-L1091 PolarHBondContact O-N 2.84Å; P1089-I1094 HydrophobicContact CB-CD1 3.96Å; P1089-I1094 HydrophobicContact CG-CD1 4.21Å; P1089-F1131 HydrophobicContact CB-CD2 4.33Å; P1089-F1131 HydrophobicContact CB-CE2 4.46Å; P1089-F1131 HydrophobicContact CG-CD2 3.98Å
1090	Y	95.2	Very high	94.4	Very high	3 Å²	3	36 Å²	36	1%	0.012	19%	0.193	C	C	.	.			trans	-72.3	111.7	160.2	172.9	-114.4	0	0	0	109.3	P541 F544 Y545 F992 L1036 Y1076 G1092 L1093	P541-Y1090 WeakPolarHBondContact CA-OH 3.49Å; P541-Y1090 HydrophobicContact CB-CE2 4.35Å; P541-Y1090 PolarHBondContact O-OH 3.2Å; F544-Y1090 WeakPolarHBondContact CB-OH 3.01Å; F544-Y1090 VanDerWaalsContact CD2-OH 3.27Å; F544-Y1090 WeakPolarHBondContact CD2-OH 3.49Å; F544-Y1090 WeakPolarHBondContact CG-OH 3.37Å; Y545-Y1090 HydrophobicContact CD2-CE2 4.15Å; Y545-Y1090 AromaticContact CE2-CD2 3.87Å; Y545-Y1090 HydrophobicContact CE2-CD2 3.87Å; Y545-Y1090 AromaticContact CE2-CE2 3.41Å; Y545-Y1090 HydrophobicContact CE2-CE2 3.41Å; Y545-Y1090 VanDerWaalsContact CE2-CE2 3.41Å; Y545-Y1090 AromaticContact CZ-CE2 3.89Å; F992-Y1090 AromaticContact CE2-CD2 3.88Å; F992-Y1090 HydrophobicContact CE2-CD2 3.88Å; F992-Y1090 AromaticContact CE2-CE2 3.8Å; F992-Y1090 HydrophobicContact CE2-CE2 3.8Å; F992-Y1090 HydrophobicContact CZ-CD2 4.37Å; F992-Y1090 AromaticContact CZ-CE2 3.85Å; F992-Y1090 HydrophobicContact CZ-CE2 3.85Å; L1036-Y1090 HydrophobicContact CB-CD2 4.32Å; L1036-Y1090 HydrophobicContact CD1-CD1 3.72Å; L1036-Y1090 HydrophobicContact CD1-CD2 3.84Å; L1036-Y1090 HydrophobicContact CD1-CE1 4.2Å; L1036-Y1090 HydrophobicContact CD1-CE2 4.3Å; L1036-Y1090 HydrophobicContact CD1-CG 3.51Å; Y1076-Y1090 PolarHBondContact OH-N 3.08Å; Y1090-G1092 VanDerWaalsContact C-N 3.29Å; Y1090-G1092 PolarHBondContact O-N 2.81Å; Y1090-L1093 HydrophobicContact CD1-CB 4.39Å; Y1090-L1093 HydrophobicContact CD1-CD1 4.19Å; Y1090-L1093 HydrophobicContact CD1-CG 3.91Å; Y1090-L1093 HydrophobicContact CE1-CG 3.96Å
1091	L	94.6	Very high	94.5	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-72.8	-19.1	-174.9	-54.8	-178.5	0	0	0	113.2	Y545 F962 I965 L985 F988 P1089 L1093 I1094 L1095 M1128	Y545-L1091 WeakPolarHBondContact OH-CA 3.48Å; Y545-L1091 WeakPolarHBondContact OH-CB 3.4Å; Y545-L1091 PolarHBondContact OH-N 3.34Å; F962-L1091 HydrophobicContact CE2-CD2 4.13Å; I965-L1091 HydrophobicContact CD1-CD1 3.52Å; L985-L1091 HydrophobicContact CD1-CD1 3.78Å; F988-L1091 HydrophobicContact CD1-CD1 3.7Å; F988-L1091 HydrophobicContact CD1-CG 4.34Å; F988-L1091 HydrophobicContact CE1-CD1 3.62Å; F988-L1091 HydrophobicContact CE1-CG 3.78Å; F988-L1091 HydrophobicContact CZ-CD1 4.36Å; F988-L1091 HydrophobicContact CZ-CG 4.46Å; P1089-L1091 HydrophobicContact CB-CD2 4.48Å; P1089-L1091 HydrophobicContact CG-CD2 3.86Å; P1089-L1091 PolarHBondContact O-N 2.84Å; L1091-L1093 VanDerWaalsContact C-N 3.26Å; L1091-L1093 PolarHBondContact O-N 3.35Å; L1091-I1094 HydrophobicContact CD2-CD1 4.02Å; L1091-I1094 PolarHBondContact O-N 3.25Å; L1091-L1095 WeakPolarHBondContact O-CG 3.29Å; L1091-L1095 PolarHBondContact O-N 3.41Å; L1091-M1128 HydrophobicContact CD2-SD 4.37Å
1092	G	92.2	Very high	94.5	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-54.4	-40.7	-178.5	0	0	0	0	0	113.2	Y545 Y1090 Q1096	Y545-G1092 PolarHBondContact OH-N 3.1Å; Y1090-G1092 VanDerWaalsContact C-N 3.29Å; Y1090-G1092 PolarHBondContact O-N 2.81Å; G1092-Q1096 WeakPolarHBondContact O-CB 3.24Å; G1092-Q1096 PolarHBondContact O-N 3.26Å
1093	L	91.9	Very high	94.5	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-73.8	-35.6	175.4	-68.6	173.7	0	0	0	113	I1067 F1073 Y1076 Y1090 L1091 L1095 Q1096 D1097	I1067-L1093 HydrophobicContact CD1-CD1 4.07Å; F1073-L1093 HydrophobicContact CB-CD1 3.84Å; F1073-L1093 HydrophobicContact CB-CD2 4.42Å; F1073-L1093 HydrophobicContact CD1-CD1 4.38Å; F1073-L1093 HydrophobicContact CD2-CD1 4.29Å; F1073-L1093 HydrophobicContact CD2-CD2 3.37Å; F1073-L1093 HydrophobicContact CD2-CG 4.49Å; F1073-L1093 HydrophobicContact CE2-CD2 3.65Å; F1073-L1093 HydrophobicContact CG-CD1 3.91Å; F1073-L1093 HydrophobicContact CG-CD2 3.85Å; F1073-L1093 HydrophobicContact CZ-CD2 4.33Å; Y1076-L1093 HydrophobicContact CD1-CD1 3.36Å; Y1076-L1093 HydrophobicContact CE1-CD1 3.6Å; Y1076-L1093 HydrophobicContact CG-CD1 4.26Å; Y1090-L1093 HydrophobicContact CD1-CB 4.39Å; Y1090-L1093 HydrophobicContact CD1-CD1 4.19Å; Y1090-L1093 HydrophobicContact CD1-CG 3.91Å; Y1090-L1093 HydrophobicContact CE1-CG 3.96Å; L1091-L1093 VanDerWaalsContact C-N 3.26Å; L1091-L1093 PolarHBondContact O-N 3.35Å; L1093-L1095 VanDerWaalsContact C-N 3.35Å; L1093-Q1096 PolarHBondContact O-N 3.35Å; L1093-D1097 PolarHBondContact O-N 2.91Å
1094	I	93.4	Very high	94.5	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.051	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-41.6	175.7	-63.9	178.2	0	0	0	110.3	P1089 L1091 D1097 L1098 I1124	P1089-I1094 HydrophobicContact CB-CD1 3.96Å; P1089-I1094 HydrophobicContact CG-CD1 4.21Å; L1091-I1094 HydrophobicContact CD2-CD1 4.02Å; L1091-I1094 PolarHBondContact O-N 3.25Å; I1094-D1097 PolarHBondContact O-N 2.75Å; I1094-L1098 HydrophobicContact CG2-CD1 4.14Å; I1094-L1098 WeakPolarHBondContact O-CB 2.73Å; I1094-L1098 VanDerWaalsContact O-CG 3.31Å; I1094-L1098 WeakPolarHBondContact O-CG 3.2Å; I1094-L1098 PolarHBondContact O-N 2.9Å; I1094-I1124 HydrophobicContact CG2-CG2 3.9Å
1095	L	94.8	Very high	94.6	Very high	12 Å²	12	27.7 Å²	27.7	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-39.3	174.4	-65.2	176.2	0	0	0	111.9	Y545 V970 W973 L985 L1091 L1093 T1099	Y545-L1095 HydrophobicContact CE1-CD1 4.38Å; V970-L1095 HydrophobicContact CG1-CD2 3.64Å; W973-L1095 HydrophobicContact CB-CD2 4.44Å; W973-L1095 HydrophobicContact CG-CD2 4.34Å; L985-L1095 HydrophobicContact CD1-CD1 4.44Å; L985-L1095 HydrophobicContact CD2-CD1 4.4Å; L985-L1095 HydrophobicContact CD2-CD2 4.11Å; L1091-L1095 WeakPolarHBondContact O-CG 3.29Å; L1091-L1095 PolarHBondContact O-N 3.41Å; L1093-L1095 VanDerWaalsContact C-N 3.35Å; L1095-T1099 VanDerWaalsContact O-CB 3.31Å; L1095-T1099 WeakPolarHBondContact O-CB 3.38Å; L1095-T1099 PolarHBondContact O-N 2.87Å; L1095-T1099 PolarHBondContact O-OG1 3.36Å
1096	Q	92.6	Very high	94.6	Very high	50 Å²	50	29.9 Å²	29.9	23%	0.234	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-48.1	173.8	-175.7	-179	3.6	0	0	111.2	G1092 L1093 L1098 T1099 F1100	G1092-Q1096 WeakPolarHBondContact O-CB 3.24Å; G1092-Q1096 PolarHBondContact O-N 3.26Å; L1093-Q1096 PolarHBondContact O-N 3.35Å; Q1096-L1098 PolarHBondContact O-N 3.24Å; Q1096-T1099 PolarHBondContact O-N 3.5Å; Q1096-F1100 WeakPolarHBondContact O-CB 3.46Å; Q1096-F1100 PolarHBondContact O-N 3.47Å
1097	D	93.9	Very high	94.6	Very high	36 Å²	36	31 Å²	31	19%	0.193	18%	0.177	C	C	.	.	H	α-helix	trans	-62.3	-44	179.3	-66.2	-21.9	0	0	0	111.8	R1077 L1093 I1094 F1100 V1101 I1124	R1077-D1097 IonicContact CZ-OD1 2.69Å; R1077-D1097 IonicContact CZ-OD2 3.66Å; R1077-D1097 IonicContact NH1-OD1 3.22Å; R1077-D1097 PolarHBondContact NH1-OD1 2.97Å; R1077-D1097 IonicContact NH1-OD2 3.55Å; R1077-D1097 PolarHBondContact NH1-OD2 2.89Å; R1077-D1097 IonicContact NH2-OD1 2.78Å; R1077-D1097 PolarHBondContact NH2-OD1 3.47Å; R1077-D1097 IonicContact NH2-OD2 3.56Å; L1093-D1097 PolarHBondContact O-N 2.91Å; I1094-D1097 PolarHBondContact O-N 2.75Å; D1097-F1100 PolarHBondContact O-N 3.34Å; D1097-V1101 WeakPolarHBondContact O-CG2 3.49Å; D1097-V1101 PolarHBondContact O-N 3.16Å; D1097-I1124 HydrophobicContact CB-CD1 3.83Å; D1097-I1124 HydrophobicContact CB-CG1 4.22Å; D1097-I1124 HydrophobicContact CB-CG2 4.06Å
1098	L	95.5	Very high	94.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-38.4	176.8	-72.8	169.2	0	0	0	112.3	V970 L971 A974 I1094 Q1096 H1102 Q1121 I1124 L1125	V970-L1098 HydrophobicContact CG1-CD1 3.64Å; L971-L1098 HydrophobicContact CD2-CD2 4.48Å; A974-L1098 HydrophobicContact CB-CB 3.64Å; I1094-L1098 HydrophobicContact CG2-CD1 4.14Å; I1094-L1098 WeakPolarHBondContact O-CB 2.73Å; I1094-L1098 VanDerWaalsContact O-CG 3.31Å; I1094-L1098 WeakPolarHBondContact O-CG 3.2Å; I1094-L1098 PolarHBondContact O-N 2.9Å; Q1096-L1098 PolarHBondContact O-N 3.24Å; L1098-H1102 VanDerWaalsContact O-CB 3.22Å; L1098-H1102 WeakPolarHBondContact O-CB 3.39Å; L1098-H1102 PolarHBondContact O-N 2.72Å; L1098-Q1121 HydrophobicContact CD2-CB 3.93Å; L1098-Q1121 HydrophobicContact CD2-CG 4.08Å; L1098-I1124 HydrophobicContact CD1-CG2 4.44Å; L1098-I1124 HydrophobicContact CD2-CB 4.06Å; L1098-I1124 HydrophobicContact CD2-CD1 4.13Å; L1098-I1124 HydrophobicContact CD2-CG2 4.01Å; L1098-I1124 HydrophobicContact CG-CB 4.41Å; L1098-I1124 HydrophobicContact CG-CG2 3.81Å; L1098-L1125 HydrophobicContact CD1-CD1 4.45Å; L1098-L1125 HydrophobicContact CD1-CD2 3.82Å; L1098-L1125 HydrophobicContact CD1-CG 4.1Å; L1098-L1125 HydrophobicContact CD2-CD1 4.22Å; L1098-L1125 HydrophobicContact CD2-CG 4.2Å
1099	T	94	Very high	94.4	Very high	30 Å²	30	37.1 Å²	37.1	18%	0.184	21%	0.209	C	C	.	.	H	α-helix	trans	-67.1	-41.7	175.5	-55.4	0	0	0	0	110.6	L1095 Q1096 H1102 L1103	L1095-T1099 VanDerWaalsContact O-CB 3.31Å; L1095-T1099 WeakPolarHBondContact O-CB 3.38Å; L1095-T1099 PolarHBondContact O-N 2.87Å; L1095-T1099 PolarHBondContact O-OG1 3.36Å; Q1096-T1099 PolarHBondContact O-N 3.5Å; T1099-H1102 PolarHBondContact O-N 3.42Å; T1099-L1103 HydrophobicContact CG2-CD1 3.92Å; T1099-L1103 HydrophobicContact CG2-CG 4.37Å; T1099-L1103 WeakPolarHBondContact O-CG 3.17Å; T1099-L1103 PolarHBondContact O-N 2.86Å
1100	F	94.9	Very high	94.3	Very high	103 Å²	103	44.1 Å²	44.1	45%	0.452	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-46.5	174.9	-179.1	-98.8	0	0	0	111.9	Y529 Q1096 D1097 H1102 L1103 G1104	Y529-F1100 HydrophobicContact CD1-CD2 4.42Å; Y529-F1100 HydrophobicContact CD1-CE2 4.23Å; Y529-F1100 AromaticContact CE1-CD2 3.75Å; Y529-F1100 HydrophobicContact CE1-CD2 3.75Å; Y529-F1100 AromaticContact CE1-CE2 3.99Å; Y529-F1100 HydrophobicContact CE1-CE2 3.99Å; Q1096-F1100 WeakPolarHBondContact O-CB 3.46Å; Q1096-F1100 PolarHBondContact O-N 3.47Å; D1097-F1100 PolarHBondContact O-N 3.34Å; F1100-H1102 VanDerWaalsContact C-N 3.32Å; F1100-H1102 PolarHBondContact O-N 3.35Å; F1100-L1103 PolarHBondContact O-N 3.49Å; F1100-G1104 WeakPolarHBondContact O-CA 3.43Å; F1100-G1104 PolarHBondContact O-N 3.35Å
1101	V	95.5	Very high	94.2	Very high	12 Å²	12	47.1 Å²	47.1	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-35.6	174.6	169.4	0	0	0	0	111.6	D1097 N1105 K1117 Q1120 Q1121 I1124	D1097-V1101 WeakPolarHBondContact O-CG2 3.49Å; D1097-V1101 PolarHBondContact O-N 3.16Å; V1101-N1105 WeakPolarHBondContact O-CB 3.37Å; V1101-N1105 PolarHBondContact O-N 3.22Å; V1101-N1105 PolarHBondContact O-ND2 2.68Å; V1101-K1117 HydrophobicContact CG1-CG 4.23Å; V1101-K1117 WeakPolarHBondContact O-CE 3.26Å; V1101-Q1120 HydrophobicContact CG1-CB 3.73Å; V1101-Q1120 HydrophobicContact CG2-CB 4.11Å; V1101-Q1121 HydrophobicContact CG1-CG 3.67Å; V1101-I1124 HydrophobicContact CB-CD1 4.41Å; V1101-I1124 HydrophobicContact CG2-CD1 3.72Å
1102	H	93.6	Very high	94.3	Very high	35 Å²	35	50.2 Å²	50.2	16%	0.162	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-45.8	177.8	-179.5	60.5	0	0	0	112.5	A974 L1098 T1099 F1100 D1107 K1117	A974-H1102 PolarHBondContact O-CD2 3.44Å; L1098-H1102 VanDerWaalsContact O-CB 3.22Å; L1098-H1102 WeakPolarHBondContact O-CB 3.39Å; L1098-H1102 PolarHBondContact O-N 2.72Å; T1099-H1102 PolarHBondContact O-N 3.42Å; F1100-H1102 VanDerWaalsContact C-N 3.32Å; F1100-H1102 PolarHBondContact O-N 3.35Å; H1102-D1107 IonicContact CE1-OD2 2.68Å; H1102-K1117 WeakPolarHBondContact O-CE 3.15Å; H1102-K1117 PolarHBondContact O-NZ 3.34Å
1103	L	92.3	Very high	94.6	Very high	109 Å²	109	50.7 Å²	50.7	57%	0.571	29%	0.294	S	S	*	.	H	α-helix	trans	-81	-36	-178.7	-63.2	175.7	0	0	0	113.1	T1099 F1100	T1099-L1103 HydrophobicContact CG2-CD1 3.92Å; T1099-L1103 HydrophobicContact CG2-CG 4.37Å; T1099-L1103 WeakPolarHBondContact O-CG 3.17Å; T1099-L1103 PolarHBondContact O-N 2.86Å; F1100-L1103 PolarHBondContact O-N 3.49Å
1104	G	94.3	Very high	94.8	Very high	58 Å²	58	50.8 Å²	50.8	60%	0.598	30%	0.295	S	S	*	.	H	α-helix	trans	-78.1	-17.6	-175.1	0	0	0	0	0	115.3	F1100	F1100-G1104 WeakPolarHBondContact O-CA 3.43Å; F1100-G1104 PolarHBondContact O-N 3.35Å
1105	N	94.8	Very high	95	Very high	40 Å²	40	50.3 Å²	50.3	21%	0.214	29%	0.292	C	S	.	.	S	Bend	trans	-118.4	134.2	-179.6	-64.1	-85.6	0	0	0	111.2	V1101 K1117 Q1120	V1101-N1105 WeakPolarHBondContact O-CB 3.37Å; V1101-N1105 PolarHBondContact O-N 3.22Å; V1101-N1105 PolarHBondContact O-ND2 2.68Å; N1105-K1117 HydrophobicContact CB-CB 3.99Å; N1105-K1117 HydrophobicContact CB-CD 3.73Å; N1105-K1117 HydrophobicContact CB-CG 3.76Å; N1105-K1117 WeakPolarHBondContact O-CD 3.43Å; N1105-K1117 VanDerWaalsContact O-CE 3.27Å; N1105-K1117 WeakPolarHBondContact O-CE 3.49Å; N1105-K1117 PolarHBondContact O-NZ 3.01Å; N1105-Q1120 PolarHBondContact ND2-OE1 3.01Å
1106	P	95.8	Very high	95.1	Very high	83 Å²	83	50.9 Å²	50.9	54%	0.539	30%	0.297	S	S	.	.			trans	-67.5	145.9	174.3	31	-35.9	0	0	0	110.7	L1108 N1114	P1106-L1108 VanDerWaalsContact C-N 3.27Å; P1106-L1108 WeakPolarHBondContact CB-O 3.46Å; P1106-L1108 PolarHBondContact O-N 3.44Å; P1106-N1114 WeakPolarHBondContact O-CB 3.35Å; P1106-N1114 PolarHBondContact O-ND2 2.93Å
1107	D	95.3	Very high	95.3	Very high	61 Å²	61	48.5 Å²	48.5	33%	0.326	29%	0.286	S	S	.	.	S	Bend	trans	-70.2	-24.8	178.9	-77.7	-54.9	0	0	0	113.7	H1102 N1114 K1117 R1118	H1102-D1107 IonicContact CE1-OD2 2.68Å; D1107-N1114 WeakPolarHBondContact O-CB 3.44Å; D1107-N1114 PolarHBondContact O-N 3.42Å; D1107-K1117 WeakPolarHBondContact OD1-CD 3.46Å; D1107-K1117 WeakPolarHBondContact OD1-CE 3.21Å; D1107-K1117 IonicContact OD1-NZ 2.98Å; D1107-K1117 PolarHBondContact OD1-NZ 3.35Å; D1107-K1117 IonicContact OD2-NZ 2.67Å; D1107-K1117 PolarHBondContact OD2-NZ 3.1Å; D1107-R1118 PolarHBondContact O-NH1 2.73Å; D1107-R1118 IonicContact OD1-CZ 3.86Å; D1107-R1118 IonicContact OD1-NH1 2.63Å; D1107-R1118 IonicContact OD1-NH2 3.67Å; D1107-R1118 PolarHBondContact OD1-NH2 2.96Å
1108	L	97.3	Very high	95.4	Very high	95 Å²	95	46.9 Å²	46.9	50%	0.497	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.6	175.7	-54.5	179	0	0	0	111.2	P1106 K1112 V1113	P1106-L1108 VanDerWaalsContact C-N 3.27Å; P1106-L1108 WeakPolarHBondContact CB-O 3.46Å; P1106-L1108 PolarHBondContact O-N 3.44Å; L1108-K1112 CarbonylContact C-O 3.53Å; L1108-K1112 WeakPolarHBondContact CA-O 3.4Å; L1108-K1112 WeakPolarHBondContact CB-O 3.43Å; L1108-V1113 HydrophobicContact CD2-CG2 4.36Å
1109	I	94.4	Very high	95.4	Very high	34 Å²	34	49.1 Å²	49.1	17%	0.174	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.1	165.4	-68.4	167.3	0	0	0	105.9	R799 A800 G1111 K1112 N1114	R799-I1109 HydrophobicContact CG-CD1 4.39Å; A800-I1109 HydrophobicContact CB-CB 4.31Å; I1109-G1111 PolarHBondContact O-N 3.21Å; I1109-G1111 VanDerWaalsContact O-N 3.16Å; I1109-K1112 PolarHBondContact N-O 3.11Å; I1109-K1112 WeakPolarHBondContact O-CA 3.42Å; I1109-K1112 WeakPolarHBondContact O-CB 3.48Å; I1109-K1112 PolarHBondContact O-N 3.49Å; I1109-K1112 VanDerWaalsContact O-O 3.14Å; I1109-N1114 HydrophobicContact CD1-CB 3.97Å; I1109-N1114 VanDerWaalsContact CD1-CG 3.47Å; I1109-N1114 HydrophobicContact CG1-CB 3.97Å
1110	D	93.1	Very high	95.5	Very high	148 Å²	148	51.3 Å²	51.3	79%	0.791	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	40.4	178.2	-48.4	-35.6	0	0	0	113.4	K1112	D1110-K1112 PolarHBondContact O-N 2.88Å; D1110-K1112 VanDerWaalsContact O-N 3.17Å
1111	G	93.9	Very high	95.5	Very high	65 Å²	65	46.6 Å²	46.6	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-15.6	-176.1	0	0	0	0	0	115.4	I1109	I1109-G1111 PolarHBondContact O-N 3.21Å; I1109-G1111 VanDerWaalsContact O-N 3.16Å
1112	K	96.8	Very high	95.5	Very high	67 Å²	67	46.2 Å²	46.2	29%	0.291	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	153	176.8	-64.9	-178.1	-177.5	-174.7	0	111.3	R785 T787 A800 G801 L1108 I1109 D1110 N1114	R785-K1112 PolarHBondContact O-NZ 3.48Å; T787-K1112 PolarHBondContact OG1-NZ 3.05Å; A800-K1112 HydrophobicContact CB-CB 4.01Å; G801-K1112 CarbonylContact O-C 3.44Å; G801-K1112 WeakPolarHBondContact O-CB 3.47Å; L1108-K1112 CarbonylContact C-O 3.53Å; L1108-K1112 WeakPolarHBondContact CA-O 3.4Å; L1108-K1112 WeakPolarHBondContact CB-O 3.43Å; I1109-K1112 PolarHBondContact N-O 3.11Å; I1109-K1112 WeakPolarHBondContact O-CA 3.42Å; I1109-K1112 WeakPolarHBondContact O-CB 3.48Å; I1109-K1112 PolarHBondContact O-N 3.49Å; I1109-K1112 VanDerWaalsContact O-O 3.14Å; D1110-K1112 PolarHBondContact O-N 2.88Å; D1110-K1112 VanDerWaalsContact O-N 3.17Å; K1112-N1114 PolarHBondContact O-N 3.05Å
1113	V	98.1	Very high	95.5	Very high	13 Å²	13	48.3 Å²	48.3	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	124.6	174.5	177.1	0	0	0	0	110	A800 G801 L806 F832 L1108 F1115	A800-V1113 WeakPolarHBondContact CA-O 3.42Å; A800-V1113 VanDerWaalsContact CB-O 3.24Å; A800-V1113 WeakPolarHBondContact CB-O 3.14Å; G801-V1113 PolarHBondContact N-O 3.01Å; G801-V1113 WeakPolarHBondContact O-CB 3.5Å; G801-V1113 PolarHBondContact O-N 2.96Å; L806-V1113 HydrophobicContact CD1-CB 3.78Å; L806-V1113 HydrophobicContact CD1-CG1 4.03Å; L806-V1113 HydrophobicContact CD1-CG2 4.47Å; F832-V1113 HydrophobicContact CB-CG1 3.81Å; F832-V1113 HydrophobicContact CB-CG2 3.99Å; F832-V1113 HydrophobicContact CD1-CG1 3.63Å; F832-V1113 HydrophobicContact CD2-CG1 4.08Å; F832-V1113 HydrophobicContact CD2-CG2 3.92Å; F832-V1113 HydrophobicContact CE1-CG1 4.13Å; F832-V1113 HydrophobicContact CG-CB 4.48Å; F832-V1113 HydrophobicContact CG-CG1 3.59Å; F832-V1113 HydrophobicContact CG-CG2 4.06Å; L1108-V1113 HydrophobicContact CD2-CG2 4.36Å; V1113-F1115 PolarHBondContact O-N 3.32Å; V1113-F1115 VanDerWaalsContact O-N 3.08Å
1114	N	97.3	Very high	95.6	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.027	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	100.2	173.7	-179.6	-8.4	0	0	0	109.7	P1106 D1107 I1109 K1112 S1116 K1117 R1118	P1106-N1114 WeakPolarHBondContact O-CB 3.35Å; P1106-N1114 PolarHBondContact O-ND2 2.93Å; D1107-N1114 WeakPolarHBondContact O-CB 3.44Å; D1107-N1114 PolarHBondContact O-N 3.42Å; I1109-N1114 HydrophobicContact CD1-CB 3.97Å; I1109-N1114 VanDerWaalsContact CD1-CG 3.47Å; I1109-N1114 HydrophobicContact CG1-CB 3.97Å; K1112-N1114 PolarHBondContact O-N 3.05Å; N1114-S1116 PolarHBondContact OD1-N 3.03Å; N1114-K1117 HydrophobicContact CB-CB 4.25Å; N1114-K1117 PolarHBondContact OD1-N 2.9Å; N1114-R1118 WeakPolarHBondContact O-CD 3.48Å; N1114-R1118 PolarHBondContact O-NH1 3.47Å
1115	F	97.3	Very high	95.5	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-81.8	-27	179.8	-161.9	-96.9	0	0	0	112.2	V798 R799 L806 Y821 A824 F825 V1113 K1117 R1118 W1119	V798-F1115 HydrophobicContact CB-CD1 4.18Å; V798-F1115 HydrophobicContact CG1-CB 4.15Å; V798-F1115 HydrophobicContact CG1-CD1 4.03Å; V798-F1115 HydrophobicContact CG1-CG 4.14Å; R799-F1115 WeakPolarHBondContact O-CA 3.28Å; R799-F1115 PolarHBondContact O-N 3Å; L806-F1115 HydrophobicContact CD1-CD2 4.21Å; L806-F1115 HydrophobicContact CD2-CB 4.4Å; L806-F1115 HydrophobicContact CD2-CD2 4.14Å; L806-F1115 HydrophobicContact CD2-CG 4.35Å; Y821-F1115 HydrophobicContact CD2-CD1 4.34Å; Y821-F1115 AromaticContact CD2-CE1 3.49Å; Y821-F1115 HydrophobicContact CD2-CE1 3.49Å; Y821-F1115 VanDerWaalsContact CD2-CE1 3.49Å; Y821-F1115 AromaticContact CD2-CZ 3.65Å; Y821-F1115 HydrophobicContact CD2-CZ 3.65Å; Y821-F1115 AromaticContact CE2-CD1 3.85Å; Y821-F1115 HydrophobicContact CE2-CD1 3.85Å; Y821-F1115 HydrophobicContact CE2-CD2 4.31Å; Y821-F1115 AromaticContact CE2-CE1 3.28Å; Y821-F1115 HydrophobicContact CE2-CE1 3.28Å; Y821-F1115 AromaticContact CE2-CE2 3.81Å; Y821-F1115 HydrophobicContact CE2-CE2 3.81Å; Y821-F1115 HydrophobicContact CE2-CG 4.33Å; Y821-F1115 AromaticContact CE2-CZ 3.26Å; Y821-F1115 HydrophobicContact CE2-CZ 3.26Å; Y821-F1115 HydrophobicContact CG-CZ 4.49Å; Y821-F1115 AromaticContact CZ-CZ 3.84Å; A824-F1115 HydrophobicContact CB-CE1 4.47Å; A824-F1115 HydrophobicContact CB-CZ 4.09Å; F825-F1115 HydrophobicContact CB-CE2 4.39Å; F825-F1115 HydrophobicContact CB-CZ 4.48Å; F825-F1115 HydrophobicContact CD2-CE2 4.45Å; V1113-F1115 PolarHBondContact O-N 3.32Å; V1113-F1115 VanDerWaalsContact O-N 3.08Å; F1115-K1117 VanDerWaalsContact C-N 3.28Å; F1115-K1117 PolarHBondContact O-N 2.85Å; F1115-R1118 HydrophobicContact CD2-CB 4.32Å; F1115-R1118 CarbonylContact O-C 3.47Å; F1115-R1118 WeakPolarHBondContact O-CA 3.4Å; F1115-R1118 WeakPolarHBondContact O-CB 3.4Å; F1115-R1118 PolarHBondContact O-N 3.34Å; F1115-W1119 AromaticContact CE1-CE3 3.92Å; F1115-W1119 HydrophobicContact CE1-CE3 3.92Å; F1115-W1119 HydrophobicContact CE1-CZ3 4.45Å; F1115-W1119 PolarHBondContact O-N 3.37Å
1116	S	96.2	Very high	95.3	Very high	24 Å²	24	43.5 Å²	43.5	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-39.3	170.9	-57.4	0	0	0	0	112.5	R799 N1114 W1119 Q1120	R799-S1116 WeakPolarHBondContact CA-OG 3.39Å; R799-S1116 PolarHBondContact O-N 3.29Å; R799-S1116 VanDerWaalsContact O-N 3.15Å; N1114-S1116 PolarHBondContact OD1-N 3.03Å; S1116-W1119 PolarHBondContact O-N 3.47Å; S1116-Q1120 WeakPolarHBondContact O-CG 3.24Å; S1116-Q1120 PolarHBondContact O-N 2.65Å; S1116-Q1120 VanDerWaalsContact O-N 3.09Å
1117	K	96.2	Very high	94.8	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-44.7	171.3	-179.9	178	-171.3	175.3	0	111.8	V1101 H1102 N1105 D1107 N1114 F1115 Q1120 Q1121	V1101-K1117 HydrophobicContact CG1-CG 4.23Å; V1101-K1117 WeakPolarHBondContact O-CE 3.26Å; H1102-K1117 WeakPolarHBondContact O-CE 3.15Å; H1102-K1117 PolarHBondContact O-NZ 3.34Å; N1105-K1117 HydrophobicContact CB-CB 3.99Å; N1105-K1117 HydrophobicContact CB-CD 3.73Å; N1105-K1117 HydrophobicContact CB-CG 3.76Å; N1105-K1117 WeakPolarHBondContact O-CD 3.43Å; N1105-K1117 VanDerWaalsContact O-CE 3.27Å; N1105-K1117 WeakPolarHBondContact O-CE 3.49Å; N1105-K1117 PolarHBondContact O-NZ 3.01Å; D1107-K1117 WeakPolarHBondContact OD1-CD 3.46Å; D1107-K1117 WeakPolarHBondContact OD1-CE 3.21Å; D1107-K1117 IonicContact OD1-NZ 2.98Å; D1107-K1117 PolarHBondContact OD1-NZ 3.35Å; D1107-K1117 IonicContact OD2-NZ 2.67Å; D1107-K1117 PolarHBondContact OD2-NZ 3.1Å; N1114-K1117 HydrophobicContact CB-CB 4.25Å; N1114-K1117 PolarHBondContact OD1-N 2.9Å; F1115-K1117 VanDerWaalsContact C-N 3.28Å; F1115-K1117 PolarHBondContact O-N 2.85Å; K1117-Q1120 PolarHBondContact O-N 3.36Å; K1117-Q1121 WeakPolarHBondContact O-CG 3.45Å; K1117-Q1121 PolarHBondContact O-N 3.21Å; K1117-Q1121 VanDerWaalsContact O-N 3.08Å
1118	R	96.6	Very high	94.5	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-37.7	179.8	-84.3	80.6	-164.9	166.5	6.3	111.4	T828 T831 F832 D1107 N1114 F1115 Q1121 F1122	T828-R1118 HydrophobicContact CG2-CB 4.4Å; T828-R1118 WeakPolarHBondContact OG1-CB 3.36Å; T828-R1118 WeakPolarHBondContact OG1-CG 3.43Å; T831-R1118 PolarHBondContact O-NH2 3.23Å; T831-R1118 PolarHBondContact OG1-NE 3Å; F832-R1118 HydrophobicContact CD1-CG 4.2Å; F832-R1118 HydrophobicContact CE1-CG 4.22Å; D1107-R1118 PolarHBondContact O-NH1 2.73Å; D1107-R1118 IonicContact OD1-CZ 3.86Å; D1107-R1118 IonicContact OD1-NH1 2.63Å; D1107-R1118 IonicContact OD1-NH2 3.67Å; D1107-R1118 PolarHBondContact OD1-NH2 2.96Å; N1114-R1118 WeakPolarHBondContact O-CD 3.48Å; N1114-R1118 PolarHBondContact O-NH1 3.47Å; F1115-R1118 HydrophobicContact CD2-CB 4.32Å; F1115-R1118 CarbonylContact O-C 3.47Å; F1115-R1118 WeakPolarHBondContact O-CA 3.4Å; F1115-R1118 WeakPolarHBondContact O-CB 3.4Å; F1115-R1118 PolarHBondContact O-N 3.34Å; R1118-Q1121 PolarHBondContact O-N 3.31Å; R1118-F1122 WeakPolarHBondContact O-CB 3.48Å; R1118-F1122 PolarHBondContact O-N 3.28Å
1119	W	95.9	Very high	94.2	Very high	46 Å²	46	36.4 Å²	36.4	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-40	174	-165.2	-96.3	0	0	0	112.9	P796 L820 A824 F1115 S1116 F1122 N1123	P796-W1119 HydrophobicContact CB-CB 4.22Å; P796-W1119 HydrophobicContact CB-CD2 3.63Å; P796-W1119 HydrophobicContact CB-CE3 3.97Å; P796-W1119 HydrophobicContact CB-CG 3.75Å; P796-W1119 HydrophobicContact CB-CZ2 4.46Å; P796-W1119 HydrophobicContact CB-CZ3 4.5Å; P796-W1119 HydrophobicContact CG-CB 3.65Å; P796-W1119 HydrophobicContact CG-CD2 4.09Å; P796-W1119 HydrophobicContact CG-CG 3.65Å; L820-W1119 HydrophobicContact CB-CH2 4.18Å; L820-W1119 HydrophobicContact CD2-CH2 3.67Å; L820-W1119 HydrophobicContact CD2-CZ2 3.77Å; L820-W1119 HydrophobicContact CG-CH2 3.66Å; L820-W1119 HydrophobicContact CG-CZ2 4.2Å; L820-W1119 HydrophobicContact CG-CZ3 4.43Å; A824-W1119 HydrophobicContact CB-CE3 3.58Å; A824-W1119 HydrophobicContact CB-CZ3 3.72Å; F1115-W1119 AromaticContact CE1-CE3 3.92Å; F1115-W1119 HydrophobicContact CE1-CE3 3.92Å; F1115-W1119 HydrophobicContact CE1-CZ3 4.45Å; F1115-W1119 PolarHBondContact O-N 3.37Å; S1116-W1119 PolarHBondContact O-N 3.47Å; W1119-F1122 PolarHBondContact O-N 2.94Å; W1119-N1123 VanDerWaalsContact CD1-ND2 3.26Å; W1119-N1123 PolarHBondContact NE1-ND2 2.92Å; W1119-N1123 PolarHBondContact O-N 2.9Å; W1119-N1123 PolarHBondContact O-ND2 2.87Å; W1119-N1123 PolarHBondContact O-OD1 3.49Å
1120	Q	95.8	Very high	94	Very high	77 Å²	77	38.2 Å²	38.2	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-45.6	172.3	-69.9	173.8	12.9	0	0	111.3	V1101 N1105 S1116 K1117 F1122 N1123 I1124	V1101-Q1120 HydrophobicContact CG1-CB 3.73Å; V1101-Q1120 HydrophobicContact CG2-CB 4.11Å; N1105-Q1120 PolarHBondContact ND2-OE1 3.01Å; S1116-Q1120 WeakPolarHBondContact O-CG 3.24Å; S1116-Q1120 PolarHBondContact O-N 2.65Å; S1116-Q1120 VanDerWaalsContact O-N 3.09Å; K1117-Q1120 PolarHBondContact O-N 3.36Å; Q1120-F1122 PolarHBondContact O-N 3.08Å; Q1120-N1123 PolarHBondContact O-N 3.02Å; Q1120-I1124 WeakPolarHBondContact O-CD1 3.22Å; Q1120-I1124 WeakPolarHBondContact O-CG1 3.2Å; Q1120-I1124 PolarHBondContact O-N 2.86Å
1121	Q	96.1	Very high	94.1	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-43.8	175.8	-66.5	174.9	-53.4	0	0	112.3	T828 L971 L1098 V1101 K1117 R1118 I1124 L1125	T828-Q1121 HydrophobicContact CG2-CB 4.29Å; L971-Q1121 HydrophobicContact CD2-CB 4.18Å; L1098-Q1121 HydrophobicContact CD2-CB 3.93Å; L1098-Q1121 HydrophobicContact CD2-CG 4.08Å; V1101-Q1121 HydrophobicContact CG1-CG 3.67Å; K1117-Q1121 WeakPolarHBondContact O-CG 3.45Å; K1117-Q1121 PolarHBondContact O-N 3.21Å; K1117-Q1121 VanDerWaalsContact O-N 3.08Å; R1118-Q1121 PolarHBondContact O-N 3.31Å; Q1121-I1124 PolarHBondContact O-N 2.99Å; Q1121-L1125 WeakPolarHBondContact O-CD1 3.49Å; Q1121-L1125 WeakPolarHBondContact O-CG 3.39Å; Q1121-L1125 PolarHBondContact O-N 3.38Å; Q1121-L1125 VanDerWaalsContact O-N 3.15Å
1122	F	95.1	Very high	94.1	Very high	4 Å²	4	30 Å²	30	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-59	-48.2	175.6	169.6	-106.9	0	0	0	112.1	L820 E823 A824 T827 T828 R1118 W1119 Q1120 I1124 L1125 D1126	L820-F1122 HydrophobicContact CD1-CE1 3.71Å; L820-F1122 HydrophobicContact CD1-CZ 3.76Å; L820-F1122 HydrophobicContact CG-CE1 4.15Å; E823-F1122 HydrophobicContact CB-CE2 3.86Å; E823-F1122 HydrophobicContact CB-CZ 3.9Å; A824-F1122 HydrophobicContact CB-CB 4.05Å; A824-F1122 HydrophobicContact CB-CD1 3.79Å; A824-F1122 HydrophobicContact CB-CD2 4.11Å; A824-F1122 HydrophobicContact CB-CE1 4.28Å; A824-F1122 HydrophobicContact CB-CG 3.69Å; T827-F1122 HydrophobicContact CG2-CD2 4.09Å; T828-F1122 HydrophobicContact CG2-CB 4.17Å; R1118-F1122 WeakPolarHBondContact O-CB 3.48Å; R1118-F1122 PolarHBondContact O-N 3.28Å; W1119-F1122 PolarHBondContact O-N 2.94Å; Q1120-F1122 PolarHBondContact O-N 3.08Å; F1122-I1124 VanDerWaalsContact C-N 3.29Å; F1122-I1124 PolarHBondContact O-N 3.08Å; F1122-L1125 CarbonylContact O-C 3.59Å; F1122-L1125 PolarHBondContact O-N 2.85Å; F1122-L1125 VanDerWaalsContact O-N 3.07Å; F1122-D1126 PolarHBondContact O-N 2.81Å
1123	N	93.4	Very high	93.8	Very high	80 Å²	80	33.3 Å²	33.3	43%	0.428	16%	0.162	S	C	.	.	H	α-helix	trans	-61.8	-35.1	-179.9	-67.6	-17.5	0	0	0	113	W1119 Q1120	W1119-N1123 VanDerWaalsContact CD1-ND2 3.26Å; W1119-N1123 PolarHBondContact NE1-ND2 2.92Å; W1119-N1123 PolarHBondContact O-N 2.9Å; W1119-N1123 PolarHBondContact O-ND2 2.87Å; W1119-N1123 PolarHBondContact O-OD1 3.49Å; Q1120-N1123 PolarHBondContact O-N 3.02Å
1124	I	93.8	Very high	93.5	Very high	34 Å²	34	35.7 Å²	35.7	17%	0.174	18%	0.177	C	C	.	.	H	α-helix	trans	-66.9	-40.5	174.7	-66.6	159.3	0	0	0	110.7	I1094 D1097 L1098 V1101 Q1120 Q1121 F1122	I1094-I1124 HydrophobicContact CG2-CG2 3.9Å; D1097-I1124 HydrophobicContact CB-CD1 3.83Å; D1097-I1124 HydrophobicContact CB-CG1 4.22Å; D1097-I1124 HydrophobicContact CB-CG2 4.06Å; L1098-I1124 HydrophobicContact CD1-CG2 4.44Å; L1098-I1124 HydrophobicContact CD2-CB 4.06Å; L1098-I1124 HydrophobicContact CD2-CD1 4.13Å; L1098-I1124 HydrophobicContact CD2-CG2 4.01Å; L1098-I1124 HydrophobicContact CG-CB 4.41Å; L1098-I1124 HydrophobicContact CG-CG2 3.81Å; V1101-I1124 HydrophobicContact CB-CD1 4.41Å; V1101-I1124 HydrophobicContact CG2-CD1 3.72Å; Q1120-I1124 WeakPolarHBondContact O-CD1 3.22Å; Q1120-I1124 WeakPolarHBondContact O-CG1 3.2Å; Q1120-I1124 PolarHBondContact O-N 2.86Å; Q1121-I1124 PolarHBondContact O-N 2.99Å; F1122-I1124 VanDerWaalsContact C-N 3.29Å; F1122-I1124 PolarHBondContact O-N 3.08Å
1125	L	93.3	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-78.5	-24.3	-178.1	-71.7	162.2	0	0	0	114.1	T827 I967 V970 L971 L1098 Q1121 F1122 S1127 M1128 R1129	T827-L1125 HydrophobicContact CG2-CD1 4.16Å; I967-L1125 HydrophobicContact CD1-CD2 4.27Å; I967-L1125 HydrophobicContact CG2-CD1 3.86Å; I967-L1125 HydrophobicContact CG2-CD2 4.13Å; I967-L1125 HydrophobicContact CG2-CG 4.4Å; V970-L1125 HydrophobicContact CB-CD2 4.18Å; V970-L1125 HydrophobicContact CG1-CD2 3.87Å; L971-L1125 HydrophobicContact CD1-CD1 4.01Å; L971-L1125 HydrophobicContact CD2-CD1 3.58Å; L971-L1125 HydrophobicContact CG-CD1 3.62Å; L1098-L1125 HydrophobicContact CD1-CD1 4.45Å; L1098-L1125 HydrophobicContact CD1-CD2 3.82Å; L1098-L1125 HydrophobicContact CD1-CG 4.1Å; L1098-L1125 HydrophobicContact CD2-CD1 4.22Å; L1098-L1125 HydrophobicContact CD2-CG 4.2Å; Q1121-L1125 WeakPolarHBondContact O-CD1 3.49Å; Q1121-L1125 WeakPolarHBondContact O-CG 3.39Å; Q1121-L1125 PolarHBondContact O-N 3.38Å; Q1121-L1125 VanDerWaalsContact O-N 3.15Å; F1122-L1125 CarbonylContact O-C 3.59Å; F1122-L1125 PolarHBondContact O-N 2.85Å; F1122-L1125 VanDerWaalsContact O-N 3.07Å; L1125-S1127 PolarHBondContact O-N 2.85Å; L1125-M1128 WeakPolarHBondContact O-CA 3.43Å; L1125-M1128 WeakPolarHBondContact O-CB 3.13Å; L1125-M1128 PolarHBondContact O-N 2.94Å; L1125-R1129 PolarHBondContact O-N 3.05Å
1126	D	89.1	Confident	93.4	Very high	71 Å²	71	42.3 Å²	42.3	38%	0.38	21%	0.206	S	C	.	.	H	α-helix	trans	-59.3	-35.7	-178.5	-168.9	61	0	0	0	112.5	F1122 M1128 R1129 R1130	F1122-D1126 PolarHBondContact O-N 2.81Å; D1126-M1128 PolarHBondContact O-N 3Å; D1126-R1129 PolarHBondContact O-N 2.92Å; D1126-R1130 WeakPolarHBondContact O-CB 3.29Å; D1126-R1130 PolarHBondContact O-N 2.91Å
1127	S	85.8	Confident	93.3	Very high	42 Å²	42	50.6 Å²	50.6	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-59.3	-44.5	172.1	-70	0	0	0	0	112.2	L1125 R1130 F1131	L1125-S1127 PolarHBondContact O-N 2.85Å; S1127-R1130 PolarHBondContact O-N 2.96Å; S1127-F1131 WeakPolarHBondContact O-CD2 3.47Å; S1127-F1131 VanDerWaalsContact O-CG 3.32Å; S1127-F1131 WeakPolarHBondContact O-CG 3.26Å; S1127-F1131 PolarHBondContact O-N 2.98Å; S1127-F1131 VanDerWaalsContact O-N 3.13Å
1128	M	90	Very high	93.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-44.8	175.6	175.3	174.9	167.6	0	0	111.4	F962 I965 I967 V970 L1091 L1125 D1126 R1130 F1131 Q1132	F962-M1128 HydrophobicContact CE2-CE 4.26Å; F962-M1128 HydrophobicContact CE2-CG 3.97Å; F962-M1128 HydrophobicContact CZ-CG 4.1Å; I965-M1128 HydrophobicContact CB-CE 3.92Å; I965-M1128 HydrophobicContact CG2-CE 3.82Å; I967-M1128 HydrophobicContact CD1-CE 3.97Å; I967-M1128 HydrophobicContact CD1-CG 4.08Å; I967-M1128 HydrophobicContact CD1-SD 3.92Å; V970-M1128 HydrophobicContact CG2-CE 3.93Å; V970-M1128 HydrophobicContact CG2-SD 3.99Å; L1091-M1128 HydrophobicContact CD2-SD 4.37Å; L1125-M1128 WeakPolarHBondContact O-CA 3.43Å; L1125-M1128 WeakPolarHBondContact O-CB 3.13Å; L1125-M1128 PolarHBondContact O-N 2.94Å; D1126-M1128 PolarHBondContact O-N 3Å; M1128-R1130 VanDerWaalsContact C-N 3.31Å; M1128-R1130 PolarHBondContact O-N 3Å; M1128-F1131 PolarHBondContact O-N 3.15Å; M1128-F1131 VanDerWaalsContact O-N 3.14Å; M1128-Q1132 PolarHBondContact O-N 3.13Å
1129	R	89.9	Confident	93.2	Very high	49 Å²	49	61.6 Å²	61.6	19%	0.185	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-40.7	176.3	-63.8	179.9	81.8	-143.1	12.8	111.8	E823 I967 L1125 D1126 Q1133	E823-R1129 IonicContact OE2-CZ 3.26Å; E823-R1129 IonicContact OE2-NH1 3.68Å; E823-R1129 PolarHBondContact OE2-NH1 3.19Å; E823-R1129 IonicContact OE2-NH2 2.72Å; E823-R1129 PolarHBondContact OE2-NH2 3.21Å; I967-R1129 HydrophobicContact CD1-CG 3.77Å; I967-R1129 HydrophobicContact CG1-CG 4.08Å; L1125-R1129 PolarHBondContact O-N 3.05Å; D1126-R1129 PolarHBondContact O-N 2.92Å; R1129-Q1133 WeakPolarHBondContact O-CG 3.2Å; R1129-Q1133 PolarHBondContact O-NE2 3.09Å
1130	R	91.1	Very high	93.2	Very high	72 Å²	72	64.6 Å²	64.6	27%	0.272	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-41.8	175.3	-174.4	-179.4	69.8	121.9	-3.7	111.8	V1083 P1085 D1126 S1127 M1128 Q1133	V1083-R1130 VanDerWaalsContact O-CZ 3.29Å; V1083-R1130 PolarHBondContact O-NH1 2.87Å; V1083-R1130 PolarHBondContact O-NH2 2.85Å; P1085-R1130 HydrophobicContact CG-CG 3.97Å; D1126-R1130 WeakPolarHBondContact O-CB 3.29Å; D1126-R1130 PolarHBondContact O-N 2.91Å; S1127-R1130 PolarHBondContact O-N 2.96Å; M1128-R1130 VanDerWaalsContact C-N 3.31Å; M1128-R1130 PolarHBondContact O-N 3Å; R1130-Q1133 PolarHBondContact O-N 2.95Å
1131	F	93.9	Very high	93.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-73.5	-29.8	-178.9	-64	-43.7	0	0	0	114	F962 L1080 V1083 P1085 C1087 P1089 S1127 M1128 Q1133	F962-F1131 HydrophobicContact CE1-CB 3.98Å; F962-F1131 HydrophobicContact CZ-CB 4.02Å; L1080-F1131 HydrophobicContact CD1-CE2 3.62Å; L1080-F1131 HydrophobicContact CD1-CZ 3.8Å; L1080-F1131 HydrophobicContact CD2-CE2 4.48Å; L1080-F1131 HydrophobicContact CG-CE2 3.91Å; L1080-F1131 HydrophobicContact CG-CZ 4.11Å; V1083-F1131 HydrophobicContact CG1-CE1 3.81Å; V1083-F1131 HydrophobicContact CG1-CZ 3.71Å; P1085-F1131 HydrophobicContact CB-CD1 4.45Å; P1085-F1131 HydrophobicContact CG-CD1 4.09Å; C1087-F1131 HydrophobicContact CB-CD1 3.53Å; C1087-F1131 HydrophobicContact CB-CE1 3.6Å; C1087-F1131 HydrophobicContact CB-CG 4.14Å; C1087-F1131 HydrophobicContact CB-CZ 4.27Å; P1089-F1131 HydrophobicContact CB-CD2 4.33Å; P1089-F1131 HydrophobicContact CB-CE2 4.46Å; P1089-F1131 HydrophobicContact CG-CD2 3.98Å; S1127-F1131 WeakPolarHBondContact O-CD2 3.47Å; S1127-F1131 VanDerWaalsContact O-CG 3.32Å; S1127-F1131 WeakPolarHBondContact O-CG 3.26Å; S1127-F1131 PolarHBondContact O-N 2.98Å; S1127-F1131 VanDerWaalsContact O-N 3.13Å; M1128-F1131 PolarHBondContact O-N 3.15Å; M1128-F1131 VanDerWaalsContact O-N 3.14Å; F1131-Q1133 VanDerWaalsContact C-N 3.27Å; F1131-Q1133 PolarHBondContact O-N 3.43Å
1132	Q	93.8	Very high	93	Very high	39 Å²	39	68.4 Å²	68.4	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-73.2	-13.3	174.5	-69.5	178	-44.4	0	0	113.7	F962 Y963 I965 M1128 H1135	F962-Q1132 HydrophobicContact CD1-CG 4.29Å; F962-Q1132 HydrophobicContact CE1-CG 3.66Å; F962-Q1132 HydrophobicContact CE2-CG 4.25Å; F962-Q1132 HydrophobicContact CZ-CG 3.63Å; F962-Q1132 PolarHBondContact O-NE2 3.5Å; Y963-Q1132 HydrophobicContact CD1-CG 4.39Å; I965-Q1132 PolarHBondContact O-NE2 3.36Å; M1128-Q1132 PolarHBondContact O-N 3.13Å; Q1132-H1135 PolarHBondContact O-CE1 2.9Å; Q1132-H1135 VanDerWaalsContact O-CE1 3.28Å
1133	Q	90.6	Very high	92.9	Very high	137 Å²	137	74.3 Å²	74.3	64%	0.64	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-28.1	-179	-73.6	166.8	35.9	0	0	114.3	R1129 R1130 F1131	R1129-Q1133 WeakPolarHBondContact O-CG 3.2Å; R1129-Q1133 PolarHBondContact O-NE2 3.09Å; R1130-Q1133 PolarHBondContact O-N 2.95Å; F1131-Q1133 VanDerWaalsContact C-N 3.27Å; F1131-Q1133 PolarHBondContact O-N 3.43Å
1134	V	93.2	Very high	92.9	Very high	63 Å²	63	70.5 Å²	70.5	38%	0.382	33%	0.33	S	S	.	.	S	Bend	trans	-116.6	123.7	-176.1	-177	0	0	0	0	109.9	Y963 P1085 P1086	Y963-V1134 PolarHBondContact OH-O 2.98Å; P1085-V1134 HydrophobicContact CB-CB 3.6Å; P1085-V1134 HydrophobicContact CB-CG1 4.34Å; P1085-V1134 HydrophobicContact CB-CG2 3.71Å; P1085-V1134 HydrophobicContact CG-CG2 4.43Å; P1086-V1134 HydrophobicContact CB-CG1 4.35Å
1135	H	94.5	Very high	92.9	Very high	109 Å²	109	69.6 Å²	69.6	51%	0.505	33%	0.325	S	S	.	.			trans	-96.8	147.7	-172.3	-71	52.6	0	0	0	112.2	Y963 Q1132	Y963-H1135 AromaticContact CD2-CD2 3.66Å; Y963-H1135 AromaticContact CD2-NE2 3.83Å; Y963-H1135 HydrophobicContact CE2-CB 4.32Å; Y963-H1135 AromaticContact CE2-CD2 3.59Å; Y963-H1135 AromaticContact CE2-CG 3.98Å; Y963-H1135 AromaticContact CG-NE2 3.92Å; Y963-H1135 WeakPolarHBondContact OH-CA 3.37Å; Q1132-H1135 PolarHBondContact O-CE1 2.9Å; Q1132-H1135 VanDerWaalsContact O-CE1 3.28Å
1136	Y	96.5	Very high	92.7	Very high	35 Å²	35	72.4 Å²	72.4	14%	0.137	35%	0.345	C	S	.	.			trans	-71.1	125.1	174.8	-76.4	-81.9	0	0	0	112.4	T955 A959 Y963 L1029 P1086 C1087 I1088 L1138	T955-Y1136 HydrophobicContact CG2-CD1 3.92Å; T955-Y1136 HydrophobicContact CG2-CD2 4.12Å; T955-Y1136 HydrophobicContact CG2-CE1 3.63Å; T955-Y1136 HydrophobicContact CG2-CE2 3.88Å; T955-Y1136 HydrophobicContact CG2-CG 4.15Å; A959-Y1136 HydrophobicContact CB-CD2 3.84Å; A959-Y1136 HydrophobicContact CB-CE2 4.43Å; Y963-Y1136 VanDerWaalsContact OH-CD2 3.25Å; Y963-Y1136 WeakPolarHBondContact OH-CD2 3.4Å; Y963-Y1136 PolarHBondContact OH-N 3.19Å; L1029-Y1136 VanDerWaalsContact O-CE1 3.24Å; L1029-Y1136 WeakPolarHBondContact O-CE1 3.25Å; L1029-Y1136 PolarHBondContact O-OH 3.3Å; P1086-Y1136 HydrophobicContact CB-CD1 3.98Å; P1086-Y1136 HydrophobicContact CB-CD2 4.06Å; P1086-Y1136 HydrophobicContact CB-CE1 3.83Å; P1086-Y1136 HydrophobicContact CB-CE2 3.88Å; P1086-Y1136 HydrophobicContact CB-CG 4.1Å; P1086-Y1136 HydrophobicContact CG-CD1 3.85Å; P1086-Y1136 HydrophobicContact CG-CE1 3.78Å; P1086-Y1136 HydrophobicContact CG-CG 4.37Å; C1087-Y1136 VanDerWaalsContact CA-OH 3.25Å; C1087-Y1136 WeakPolarHBondContact CA-OH 3.37Å; C1087-Y1136 PolarHBondContact N-OH 2.96Å; I1088-Y1136 HydrophobicContact CD1-CE2 3.86Å; I1088-Y1136 HydrophobicContact CG1-CE2 3.54Å; Y1136-L1138 HydrophobicContact CD1-CD1 3.99Å; Y1136-L1138 HydrophobicContact CD1-CG 4.4Å; Y1136-L1138 HydrophobicContact CG-CD1 4.19Å; Y1136-L1138 PolarHBondContact O-N 3.42Å; Y1136-L1138 VanDerWaalsContact O-N 3.11Å
1137	E	94.5	Very high	92.8	Very high	199 Å²	199	69.3 Å²	69.3	93%	0.93	33%	0.328	S	S	*	.			trans	-85.6	45.8	174.3	-61.2	-168.2	171.2	0	0	112.8
1138	L	95.4	Very high	93.1	Very high	46 Å²	46	67.4 Å²	67.4	24%	0.241	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-87.9	144.7	-177.1	-65.6	172.2	0	0	0	111.9	D952 T955 L956 Y1136	D952-L1138 HydrophobicContact CB-CD2 4.22Å; D952-L1138 WeakPolarHBondContact O-CD1 3.17Å; T955-L1138 HydrophobicContact CG2-CD1 3.87Å; L956-L1138 HydrophobicContact CD1-CB 4.3Å; Y1136-L1138 HydrophobicContact CD1-CD1 3.99Å; Y1136-L1138 HydrophobicContact CD1-CG 4.4Å; Y1136-L1138 HydrophobicContact CG-CD1 4.19Å; Y1136-L1138 PolarHBondContact O-N 3.42Å; Y1136-L1138 VanDerWaalsContact O-N 3.11Å
1139	K	95.1	Very high	93.1	Very high	188 Å²	188	70.3 Å²	70.3	82%	0.817	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-90.5	128.6	176.5	-69.2	-177.3	-179.2	177.1	0	110.5	Q953	Q953-K1139 PolarHBondContact NE2-O 3.36Å
1140	R	96.4	Very high	93	Very high	108 Å²	108	74 Å²	74	41%	0.408	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-71.7	136	175.9	-163.8	167.4	167.6	110.6	7.8	111.4	L956 E960 E1142 I1145	L956-R1140 HydrophobicContact CD1-CB 3.9Å; L956-R1140 HydrophobicContact CD1-CG 4.3Å; L956-R1140 HydrophobicContact CD2-CG 4.2Å; E960-R1140 IonicContact OE1-NH1 3.51Å; E960-R1140 PolarHBondContact OE1-NH1 3.23Å; E960-R1140 IonicContact OE2-NH1 3.55Å; E960-R1140 PolarHBondContact OE2-NH1 3.15Å; R1140-E1142 VanDerWaalsContact CD-OE1 3.22Å; R1140-E1142 WeakPolarHBondContact CD-OE1 3.37Å; R1140-E1142 WeakPolarHBondContact CG-OE1 3.42Å; R1140-E1142 IonicContact CZ-OE1 2.82Å; R1140-E1142 IonicContact CZ-OE2 2.72Å; R1140-E1142 IonicContact NE-OE1 3.18Å; R1140-E1142 PolarHBondContact NE-OE1 3.31Å; R1140-E1142 IonicContact NE-OE2 3.21Å; R1140-E1142 PolarHBondContact NE-OE2 2.96Å; R1140-E1142 IonicContact NH2-OE2 2.78Å; R1140-E1142 PolarHBondContact NH2-OE2 3.23Å; R1140-I1145 HydrophobicContact CG-CG1 4.43Å
1141	N	95.2	Very high	93.1	Very high	49 Å²	49	70.6 Å²	70.6	26%	0.262	34%	0.341	S	S	.	.			trans	-126.5	101.2	175.9	-179.6	-7.6	0	0	0	109.8	Q953 E1143 I1144 I1145	Q953-N1141 HydrophobicContact CG-CB 4.32Å; N1141-E1143 PolarHBondContact O-N 2.76Å; N1141-E1143 WeakPolarHBondContact OD1-CB 3.15Å; N1141-E1143 PolarHBondContact OD1-N 2.81Å; N1141-E1143 VanDerWaalsContact OD1-N 3.1Å; N1141-I1144 HydrophobicContact CB-CD1 4.41Å; N1141-I1144 WeakPolarHBondContact ND2-CD1 3.32Å; N1141-I1144 PolarHBondContact O-N 3.1Å; N1141-I1144 VanDerWaalsContact O-N 3.16Å; N1141-I1145 WeakPolarHBondContact O-CG1 3.26Å; N1141-I1145 PolarHBondContact O-N 2.71Å; N1141-I1145 VanDerWaalsContact O-N 3.08Å
1142	E	93	Very high	92.8	Very high	111 Å²	111	73.9 Å²	73.9	52%	0.519	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-20.9	-175.1	-55	-57	159	0	0	114	R1140 S1146	R1140-E1142 VanDerWaalsContact CD-OE1 3.22Å; R1140-E1142 WeakPolarHBondContact CD-OE1 3.37Å; R1140-E1142 WeakPolarHBondContact CG-OE1 3.42Å; R1140-E1142 IonicContact CZ-OE1 2.82Å; R1140-E1142 IonicContact CZ-OE2 2.72Å; R1140-E1142 IonicContact NE-OE1 3.18Å; R1140-E1142 PolarHBondContact NE-OE1 3.31Å; R1140-E1142 IonicContact NE-OE2 3.21Å; R1140-E1142 PolarHBondContact NE-OE2 2.96Å; R1140-E1142 IonicContact NH2-OE2 2.78Å; R1140-E1142 PolarHBondContact NH2-OE2 3.23Å; E1142-S1146 WeakPolarHBondContact O-CB 3.28Å; E1142-S1146 PolarHBondContact O-N 3.43Å
1143	E	92.3	Very high	92.5	Very high	128 Å²	128	75 Å²	75	60%	0.598	37%	0.371	S	S	*	.	H	α-helix	trans	-66.8	-44.5	174.4	-61.4	-178.6	168.5	0	0	110.9	F945 N1141 F1147	F945-E1143 HydrophobicContact CE1-CB 4.3Å; N1141-E1143 PolarHBondContact O-N 2.76Å; N1141-E1143 WeakPolarHBondContact OD1-CB 3.15Å; N1141-E1143 PolarHBondContact OD1-N 2.81Å; N1141-E1143 VanDerWaalsContact OD1-N 3.1Å; E1143-F1147 WeakPolarHBondContact O-CB 3.29Å; E1143-F1147 PolarHBondContact O-N 2.95Å
1144	I	94.1	Very high	92.6	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-72.4	-40.4	178.3	-64.9	174.8	0	0	0	110.7	F945 E949 Q953 N1141 F1147 F1148	F945-I1144 HydrophobicContact CB-CD1 4.17Å; F945-I1144 HydrophobicContact CB-CG1 4.26Å; F945-I1144 HydrophobicContact CD1-CD1 3.96Å; F945-I1144 HydrophobicContact CD1-CG1 3.41Å; F945-I1144 VanDerWaalsContact CD1-CG1 3.41Å; F945-I1144 HydrophobicContact CD2-CG1 4.34Å; F945-I1144 HydrophobicContact CE1-CG1 3.71Å; F945-I1144 HydrophobicContact CG-CD1 4.19Å; F945-I1144 HydrophobicContact CG-CG1 3.75Å; F945-I1144 HydrophobicContact CZ-CG1 4.3Å; E949-I1144 HydrophobicContact CB-CD1 3.64Å; Q953-I1144 HydrophobicContact CB-CG2 3.77Å; Q953-I1144 HydrophobicContact CG-CB 3.83Å; Q953-I1144 HydrophobicContact CG-CD1 4.2Å; Q953-I1144 HydrophobicContact CG-CG2 3.57Å; N1141-I1144 HydrophobicContact CB-CD1 4.41Å; N1141-I1144 WeakPolarHBondContact ND2-CD1 3.32Å; N1141-I1144 PolarHBondContact O-N 3.1Å; N1141-I1144 VanDerWaalsContact O-N 3.16Å; I1144-F1147 WeakPolarHBondContact O-CB 3.4Å; I1144-F1147 PolarHBondContact O-N 2.86Å; I1144-F1148 HydrophobicContact CG2-CD2 4.49Å; I1144-F1148 HydrophobicContact CG2-CE1 4.06Å; I1144-F1148 HydrophobicContact CG2-CE2 3.83Å; I1144-F1148 HydrophobicContact CG2-CZ 3.57Å; I1144-F1148 WeakPolarHBondContact O-CG 3.31Å; I1144-F1148 PolarHBondContact O-N 3.46Å
1145	I	92.1	Very high	92.6	Very high	16 Å²	16	71 Å²	71	8%	0.082	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-44.4	175.2	-59.6	-66.1	0	0	0	110.6	Q953 L957 R1140 N1141 F1147 F1148 N1149	Q953-I1145 HydrophobicContact CB-CD1 4Å; Q953-I1145 HydrophobicContact CG-CD1 4.41Å; L957-I1145 HydrophobicContact CD1-CD1 3.82Å; L957-I1145 HydrophobicContact CD2-CD1 4.06Å; L957-I1145 HydrophobicContact CG-CD1 3.84Å; R1140-I1145 HydrophobicContact CG-CG1 4.43Å; N1141-I1145 WeakPolarHBondContact O-CG1 3.26Å; N1141-I1145 PolarHBondContact O-N 2.71Å; N1141-I1145 VanDerWaalsContact O-N 3.08Å; I1145-F1147 VanDerWaalsContact C-N 3.25Å; I1145-F1147 PolarHBondContact O-N 2.73Å; I1145-F1148 HydrophobicContact CD1-CD2 4.33Å; I1145-F1148 HydrophobicContact CD1-CE2 4.45Å; I1145-F1148 PolarHBondContact O-N 3Å; I1145-F1148 VanDerWaalsContact O-N 3.16Å; I1145-N1149 PolarHBondContact O-N 2.89Å
1146	S	89.7	Confident	92.5	Very high	59 Å²	59	68.5 Å²	68.5	41%	0.413	35%	0.347	S	S	.	.	H	α-helix	trans	-66.6	-24.6	175.2	-175.8	0	0	0	0	113.3	E1142	E1142-S1146 WeakPolarHBondContact O-CB 3.28Å; E1142-S1146 PolarHBondContact O-N 3.43Å
1147	F	91.4	Very high	92.2	Very high	6 Å²	6	70.7 Å²	70.7	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-73.7	-33.9	172.2	162.4	-97.6	0	0	0	112.4	L942 F945 W998 E1143 I1144 I1145	L942-F1147 HydrophobicContact CB-CZ 3.97Å; L942-F1147 HydrophobicContact CD1-CE1 3.87Å; L942-F1147 HydrophobicContact CD1-CZ 4.03Å; F945-F1147 HydrophobicContact CD2-CD1 4.23Å; F945-F1147 HydrophobicContact CD2-CG 4.34Å; F945-F1147 HydrophobicContact CE2-CB 3.79Å; F945-F1147 AromaticContact CE2-CD1 3.93Å; F945-F1147 HydrophobicContact CE2-CD1 3.93Å; F945-F1147 AromaticContact CE2-CD2 3.96Å; F945-F1147 HydrophobicContact CE2-CD2 3.96Å; F945-F1147 AromaticContact CE2-CG 3.6Å; F945-F1147 HydrophobicContact CE2-CG 3.6Å; F945-F1147 HydrophobicContact CZ-CB 4.12Å; F945-F1147 HydrophobicContact CZ-CG 4.4Å; W998-F1147 AromaticContact CH2-CE1 3.77Å; W998-F1147 HydrophobicContact CH2-CE1 3.77Å; W998-F1147 HydrophobicContact CH2-CZ 4.24Å; W998-F1147 HydrophobicContact CZ2-CD1 4.44Å; W998-F1147 AromaticContact CZ2-CE1 3.72Å; W998-F1147 HydrophobicContact CZ2-CE1 3.72Å; W998-F1147 AromaticContact CZ2-CZ 3.96Å; W998-F1147 HydrophobicContact CZ2-CZ 3.96Å; E1143-F1147 WeakPolarHBondContact O-CB 3.29Å; E1143-F1147 PolarHBondContact O-N 2.95Å; I1144-F1147 WeakPolarHBondContact O-CB 3.4Å; I1144-F1147 PolarHBondContact O-N 2.86Å; I1145-F1147 VanDerWaalsContact C-N 3.25Å; I1145-F1147 PolarHBondContact O-N 2.73Å
1148	F	92.4	Very high	92.1	Very high	2 Å²	2	67 Å²	67	1%	0.009	34%	0.341	C	S	.	.	H	α-helix	trans	-67.1	-33.7	174.7	-63.3	-32	0	0	0	113	I950 Q953 L954 L957 W998 I1144 I1145 D1150 F1151	I950-F1148 HydrophobicContact CG2-CE1 4.11Å; I950-F1148 HydrophobicContact CG2-CZ 4.06Å; Q953-F1148 HydrophobicContact CB-CE2 3.7Å; Q953-F1148 HydrophobicContact CB-CZ 4.16Å; L954-F1148 HydrophobicContact CD2-CE1 4.11Å; L954-F1148 HydrophobicContact CD2-CE2 3.9Å; L954-F1148 HydrophobicContact CD2-CZ 3.64Å; L954-F1148 HydrophobicContact CG-CE2 4.34Å; L954-F1148 HydrophobicContact CG-CZ 3.87Å; L957-F1148 HydrophobicContact CD1-CD2 3.71Å; L957-F1148 HydrophobicContact CD1-CE2 4.13Å; W998-F1148 AromaticContact CH2-CD1 3.84Å; W998-F1148 HydrophobicContact CH2-CD1 3.84Å; W998-F1148 HydrophobicContact CH2-CE1 4.14Å; W998-F1148 HydrophobicContact CZ2-CD1 4.05Å; I1144-F1148 HydrophobicContact CG2-CD2 4.49Å; I1144-F1148 HydrophobicContact CG2-CE1 4.06Å; I1144-F1148 HydrophobicContact CG2-CE2 3.83Å; I1144-F1148 HydrophobicContact CG2-CZ 3.57Å; I1144-F1148 WeakPolarHBondContact O-CG 3.31Å; I1144-F1148 PolarHBondContact O-N 3.46Å; I1145-F1148 HydrophobicContact CD1-CD2 4.33Å; I1145-F1148 HydrophobicContact CD1-CE2 4.45Å; I1145-F1148 PolarHBondContact O-N 3Å; I1145-F1148 VanDerWaalsContact O-N 3.16Å; F1148-D1150 VanDerWaalsContact C-N 3.34Å; F1148-D1150 PolarHBondContact O-N 2.88Å; F1148-F1151 HydrophobicContact CB-CD1 4.35Å; F1148-F1151 HydrophobicContact CB-CE1 3.78Å; F1148-F1151 HydrophobicContact CB-CE2 4.33Å; F1148-F1151 HydrophobicContact CB-CZ 3.74Å; F1148-F1151 AromaticContact CD1-CE1 3.69Å; F1148-F1151 HydrophobicContact CD1-CE1 3.69Å; F1148-F1151 AromaticContact CD1-CZ 3.9Å; F1148-F1151 HydrophobicContact CD1-CZ 3.9Å; F1148-F1151 HydrophobicContact CD2-CE1 4.36Å; F1148-F1151 AromaticContact CD2-CZ 3.75Å; F1148-F1151 HydrophobicContact CD2-CZ 3.75Å; F1148-F1151 HydrophobicContact CE1-CE1 4.34Å; F1148-F1151 HydrophobicContact CE1-CZ 4.41Å; F1148-F1151 HydrophobicContact CE2-CZ 4.25Å; F1148-F1151 AromaticContact CG-CE1 3.71Å; F1148-F1151 HydrophobicContact CG-CE1 3.71Å; F1148-F1151 HydrophobicContact CG-CE2 4.46Å; F1148-F1151 AromaticContact CG-CZ 3.55Å; F1148-F1151 HydrophobicContact CG-CZ 3.55Å; F1148-F1151 WeakPolarHBondContact O-CA 3.28Å; F1148-F1151 PolarHBondContact O-N 3.43Å
1149	N	89.8	Confident	92.2	Very high	60 Å²	60	66.4 Å²	66.4	32%	0.321	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	52.4	48.2	176.8	-168.6	32.1	0	0	0	112.9	I1145 F1151 S1152 D1153	I1145-N1149 PolarHBondContact O-N 2.89Å; N1149-F1151 PolarHBondContact O-N 3.49Å; N1149-S1152 WeakPolarHBondContact O-CB 3.41Å; N1149-S1152 PolarHBondContact O-N 3.44Å; N1149-S1152 PolarHBondContact O-OG 3.35Å; N1149-D1153 VanDerWaalsContact ND2-CG 3.32Å; N1149-D1153 PolarHBondContact ND2-OD1 3.33Å; N1149-D1153 PolarHBondContact ND2-OD2 3.38Å
1150	D	87.7	Confident	92.2	Very high	127 Å²	127	57.5 Å²	57.5	68%	0.679	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	51	23.8	-173.2	-60.2	-28.7	0	0	0	114.7	F1148 S1152	F1148-D1150 VanDerWaalsContact C-N 3.34Å; F1148-D1150 PolarHBondContact O-N 2.88Å; D1150-S1152 PolarHBondContact O-N 2.95Å
1151	F	94	Very high	92.1	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	57.4	11.3	-171.4	-55.9	-71	0	0	0	114.8	L954 L957 H991 N994 M995 W998 F1148 N1149 D1153 H1154	L954-F1151 HydrophobicContact CD2-CE1 4.11Å; L954-F1151 HydrophobicContact CD2-CE2 4.43Å; L954-F1151 HydrophobicContact CD2-CZ 3.5Å; L957-F1151 HydrophobicContact CD1-CE2 4.15Å; L957-F1151 HydrophobicContact CD1-CZ 4.49Å; H991-F1151 AromaticContact CE1-CD2 3.8Å; H991-F1151 AromaticContact CE1-CE2 3.56Å; H991-F1151 AromaticContact NE2-CE2 3.82Å; N994-F1151 HydrophobicContact CB-CB 4.01Å; M995-F1151 HydrophobicContact CB-CD1 4.38Å; M995-F1151 HydrophobicContact CB-CD2 4.26Å; M995-F1151 HydrophobicContact CB-CG 4.21Å; M995-F1151 HydrophobicContact CE-CE2 4.17Å; M995-F1151 HydrophobicContact CE-CZ 4.35Å; M995-F1151 HydrophobicContact CG-CD1 4.27Å; M995-F1151 HydrophobicContact CG-CE1 4.11Å; M995-F1151 HydrophobicContact CG-CE2 4.46Å; M995-F1151 HydrophobicContact CG-CZ 4.23Å; W998-F1151 HydrophobicContact CB-CB 4.07Å; W998-F1151 HydrophobicContact CB-CD1 4.06Å; W998-F1151 AromaticContact CD2-CD1 3.59Å; W998-F1151 HydrophobicContact CD2-CD1 3.59Å; W998-F1151 HydrophobicContact CD2-CE1 4.09Å; W998-F1151 AromaticContact CE2-CD1 3.98Å; W998-F1151 AromaticContact CE3-CD1 3.75Å; W998-F1151 HydrophobicContact CE3-CD1 3.75Å; W998-F1151 AromaticContact CE3-CE1 3.88Å; W998-F1151 HydrophobicContact CE3-CE1 3.88Å; W998-F1151 HydrophobicContact CG-CB 4.33Å; W998-F1151 AromaticContact CG-CD1 3.77Å; W998-F1151 HydrophobicContact CG-CD1 3.77Å; W998-F1151 HydrophobicContact CH2-CE1 4.2Å; W998-F1151 HydrophobicContact CZ2-CD1 4.49Å; W998-F1151 HydrophobicContact CZ2-CE1 4.37Å; W998-F1151 HydrophobicContact CZ3-CD1 4.29Å; W998-F1151 AromaticContact CZ3-CE1 3.95Å; W998-F1151 HydrophobicContact CZ3-CE1 3.95Å; F1148-F1151 HydrophobicContact CB-CD1 4.35Å; F1148-F1151 HydrophobicContact CB-CE1 3.78Å; F1148-F1151 HydrophobicContact CB-CE2 4.33Å; F1148-F1151 HydrophobicContact CB-CZ 3.74Å; F1148-F1151 AromaticContact CD1-CE1 3.69Å; F1148-F1151 HydrophobicContact CD1-CE1 3.69Å; F1148-F1151 AromaticContact CD1-CZ 3.9Å; F1148-F1151 HydrophobicContact CD1-CZ 3.9Å; F1148-F1151 HydrophobicContact CD2-CE1 4.36Å; F1148-F1151 AromaticContact CD2-CZ 3.75Å; F1148-F1151 HydrophobicContact CD2-CZ 3.75Å; F1148-F1151 HydrophobicContact CE1-CE1 4.34Å; F1148-F1151 HydrophobicContact CE1-CZ 4.41Å; F1148-F1151 HydrophobicContact CE2-CZ 4.25Å; F1148-F1151 AromaticContact CG-CE1 3.71Å; F1148-F1151 HydrophobicContact CG-CE1 3.71Å; F1148-F1151 HydrophobicContact CG-CE2 4.46Å; F1148-F1151 AromaticContact CG-CZ 3.55Å; F1148-F1151 HydrophobicContact CG-CZ 3.55Å; F1148-F1151 WeakPolarHBondContact O-CA 3.28Å; F1148-F1151 PolarHBondContact O-N 3.43Å; N1149-F1151 PolarHBondContact O-N 3.49Å; F1151-D1153 VanDerWaalsContact C-N 3.29Å; F1151-D1153 PolarHBondContact O-N 3.44Å; F1151-H1154 PolarHBondContact O-CD2 3.5Å
1152	S	87.4	Confident	92.2	Very high	68 Å²	68	60.4 Å²	60.4	48%	0.476	32%	0.317	S	S	.	.			trans	-69.4	-19.8	-170.6	64.9	0	0	0	0	114.9	N1149 D1150 H1154	N1149-S1152 WeakPolarHBondContact O-CB 3.41Å; N1149-S1152 PolarHBondContact O-N 3.44Å; N1149-S1152 PolarHBondContact O-OG 3.35Å; D1150-S1152 PolarHBondContact O-N 2.95Å; S1152-H1154 PolarHBondContact O-N 3.08Å
1153	D	87	Confident	92.3	Very high	64 Å²	64	57.5 Å²	57.5	34%	0.342	31%	0.305	S	S	.	.			trans	-82.2	57	177.9	-68.6	-36.5	0	0	0	112.5	R938 N1149 F1151	R938-D1153 IonicContact CZ-OD2 3.82Å; R938-D1153 IonicContact NE-OD2 3.88Å; R938-D1153 VanDerWaalsContact NH2-CG 3.26Å; R938-D1153 IonicContact NH2-OD2 3.29Å; R938-D1153 PolarHBondContact NH2-OD2 3.41Å; N1149-D1153 VanDerWaalsContact ND2-CG 3.32Å; N1149-D1153 PolarHBondContact ND2-OD1 3.33Å; N1149-D1153 PolarHBondContact ND2-OD2 3.38Å; F1151-D1153 VanDerWaalsContact C-N 3.29Å; F1151-D1153 PolarHBondContact O-N 3.44Å
1154	H	93	Very high	92.5	Very high	70 Å²	70	51.4 Å²	51.4	32%	0.324	28%	0.277	S	S	.	.			trans	-115.5	164.5	176.8	75.8	87.2	0	0	0	113.3	Y997 W998 S1001 F1151 S1152	Y997-H1154 WeakPolarHBondContact CB-ND1 3.48Å; W998-H1154 HydrophobicContact CB-CB 4.4Å; S1001-H1154 WeakPolarHBondContact OG-CA 3.31Å; F1151-H1154 PolarHBondContact O-CD2 3.5Å; S1152-H1154 PolarHBondContact O-N 3.08Å
1155	L	92.5	Very high	92.6	Very high	46 Å²	46	53.5 Å²	53.5	24%	0.241	29%	0.288	C	S	.	.			trans	-93.3	156	174	-62.2	174.9	0	0	0	110.9	S1001 I1004 Q1005 A1159 L1160 L1163	S1001-L1155 PolarHBondContact OG-N 3.33Å; I1004-L1155 HydrophobicContact CG2-CD1 4.31Å; Q1005-L1155 HydrophobicContact CG-CD1 4.12Å; L1155-A1159 HydrophobicContact CB-CB 4.35Å; L1155-L1160 HydrophobicContact CB-CD2 3.85Å; L1155-L1160 HydrophobicContact CB-CG 4.04Å; L1155-L1160 HydrophobicContact CD1-CD2 4.03Å; L1155-L1160 HydrophobicContact CG-CD2 4.48Å; L1155-L1163 HydrophobicContact CD1-CD1 3.54Å
1156	A	92.8	Very high	92.7	Very high	55 Å²	55	60.6 Å²	60.6	46%	0.455	32%	0.318	S	S	.	.			trans	-70.7	158.4	168.5	0	0	0	0	0	111.6	E1158 A1159 L1160	A1156-E1158 VanDerWaalsContact C-N 3.32Å; A1156-E1158 PolarHBondContact O-N 2.76Å; A1156-A1159 PolarHBondContact O-N 2.76Å; A1156-A1159 VanDerWaalsContact O-N 3.13Å; A1156-L1160 WeakPolarHBondContact O-CG 3.24Å; A1156-L1160 PolarHBondContact O-N 2.78Å
1157	E	90.6	Very high	93	Very high	82 Å²	82	60.4 Å²	60.4	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-38.3	-173.1	-165.9	173.4	162.8	0	0	112.6	Q546 Y997 A1159 L1160 W1161	Q546-E1157 PolarHBondContact NE2-OE2 3.37Å; Y997-E1157 HydrophobicContact CE1-CB 4.11Å; Y997-E1157 HydrophobicContact CE1-CG 4.39Å; Y997-E1157 PolarHBondContact OH-OE2 3.25Å; Y997-E1157 VanDerWaalsContact OH-OE2 3.13Å; E1157-A1159 PolarHBondContact O-N 3.05Å; E1157-L1160 PolarHBondContact O-N 3.25Å; E1157-W1161 WeakPolarHBondContact O-CB 3.47Å; E1157-W1161 PolarHBondContact O-N 3.4Å
1158	E	93.1	Very high	93	Very high	121 Å²	121	62.9 Å²	62.9	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-62.3	-44	175.7	-58.2	71.9	-159.1	0	0	111	A1156 W1161 E1162	A1156-E1158 VanDerWaalsContact C-N 3.32Å; A1156-E1158 PolarHBondContact O-N 2.76Å; E1158-W1161 PolarHBondContact O-N 3.14Å; E1158-E1162 WeakPolarHBondContact O-CB 3.26Å; E1158-E1162 WeakPolarHBondContact O-CG 3.37Å; E1158-E1162 PolarHBondContact O-N 3.22Å
1159	A	95.6	Very high	92.9	Very high	34 Å²	34	67.1 Å²	67.1	28%	0.281	35%	0.35	S	S	.	.	H	α-helix	trans	-68.4	-37	179.7	0	0	0	0	0	111.9	L1155 A1156 E1157 L1163	L1155-A1159 HydrophobicContact CB-CB 4.35Å; A1156-A1159 PolarHBondContact O-N 2.76Å; A1156-A1159 VanDerWaalsContact O-N 3.13Å; E1157-A1159 PolarHBondContact O-N 3.05Å; A1159-L1163 WeakPolarHBondContact O-CB 3.5Å; A1159-L1163 VanDerWaalsContact O-CG 3.28Å; A1159-L1163 WeakPolarHBondContact O-CG 3.33Å; A1159-L1163 PolarHBondContact O-N 3.02Å
1160	L	96.1	Very high	92.8	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-46.2	169.7	-66.1	174.8	0	0	0	110.7	Y997 R1000 I1004 P1046 L1155 A1156 E1157 L1163 S1164	Y997-L1160 HydrophobicContact CD1-CD1 3.75Å; Y997-L1160 HydrophobicContact CE1-CD1 4.2Å; R1000-L1160 HydrophobicContact CB-CD1 3.68Å; R1000-L1160 HydrophobicContact CB-CD2 4.11Å; R1000-L1160 HydrophobicContact CG-CD1 4.39Å; I1004-L1160 WeakPolarHBondContact CD1-O 3.32Å; I1004-L1160 HydrophobicContact CG2-CD2 3.54Å; P1046-L1160 HydrophobicContact CB-CB 4.27Å; P1046-L1160 HydrophobicContact CG-CB 4.06Å; L1155-L1160 HydrophobicContact CB-CD2 3.85Å; L1155-L1160 HydrophobicContact CB-CG 4.04Å; L1155-L1160 HydrophobicContact CD1-CD2 4.03Å; L1155-L1160 HydrophobicContact CG-CD2 4.48Å; A1156-L1160 WeakPolarHBondContact O-CG 3.24Å; A1156-L1160 PolarHBondContact O-N 2.78Å; E1157-L1160 PolarHBondContact O-N 3.25Å; L1160-L1163 PolarHBondContact O-N 2.94Å; L1160-S1164 PolarHBondContact O-N 2.88Å
1161	W	95.2	Very high	92.2	Very high	79 Å²	79	73.1 Å²	73.1	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-44	179.6	-178.2	-108.8	0	0	0	113	A1045 P1046 E1157 E1158 S1164 L1165	A1045-W1161 HydrophobicContact CB-CZ3 4.23Å; P1046-W1161 HydrophobicContact CG-CE3 4.3Å; E1157-W1161 WeakPolarHBondContact O-CB 3.47Å; E1157-W1161 PolarHBondContact O-N 3.4Å; E1158-W1161 PolarHBondContact O-N 3.14Å; W1161-S1164 WeakPolarHBondContact O-CB 3.42Å; W1161-S1164 PolarHBondContact O-N 3.17Å; W1161-L1165 HydrophobicContact CZ2-CD2 4.08Å; W1161-L1165 HydrophobicContact CZ2-CG 4.34Å; W1161-L1165 WeakPolarHBondContact O-CG 3.38Å; W1161-L1165 PolarHBondContact O-N 3.22Å
1162	E	96.3	Very high	90.8	Very high	139 Å²	139	78.3 Å²	78.3	65%	0.65	40%	0.397	S	S	*	.	H	α-helix	trans	-62.4	-43	175.6	-75.4	-169.3	161.9	0	0	112.4	E1158 S1164 L1165 K1166	E1158-E1162 WeakPolarHBondContact O-CB 3.26Å; E1158-E1162 WeakPolarHBondContact O-CG 3.37Å; E1158-E1162 PolarHBondContact O-N 3.22Å; E1162-S1164 VanDerWaalsContact C-N 3.32Å; E1162-S1164 PolarHBondContact O-N 2.95Å; E1162-L1165 PolarHBondContact O-N 3.01Å; E1162-K1166 WeakPolarHBondContact O-CB 3.45Å; E1162-K1166 PolarHBondContact O-N 3.24Å
1163	L	96	Very high	89	Confident	51 Å²	51	81.2 Å²	81.2	27%	0.267	41%	0.407	S	S	.	.	H	α-helix	trans	-63.4	-38.4	174.1	-72.3	175.4	0	0	0	111.7	I1004 L1155 A1159 L1160 L1165 K1166 I1167	I1004-L1163 HydrophobicContact CD1-CB 4.43Å; I1004-L1163 HydrophobicContact CG1-CB 4.11Å; I1004-L1163 HydrophobicContact CG2-CB 4.43Å; I1004-L1163 HydrophobicContact CG2-CD1 4.08Å; L1155-L1163 HydrophobicContact CD1-CD1 3.54Å; A1159-L1163 WeakPolarHBondContact O-CB 3.5Å; A1159-L1163 VanDerWaalsContact O-CG 3.28Å; A1159-L1163 WeakPolarHBondContact O-CG 3.33Å; A1159-L1163 PolarHBondContact O-N 3.02Å; L1160-L1163 PolarHBondContact O-N 2.94Å; L1163-L1165 PolarHBondContact O-N 3.27Å; L1163-K1166 HydrophobicContact CD2-CD 4.39Å; L1163-K1166 WeakPolarHBondContact O-CB 3.3Å; L1163-K1166 PolarHBondContact O-N 2.5Å; L1163-I1167 VanDerWaalsContact O-CG1 3.29Å; L1163-I1167 WeakPolarHBondContact O-CG1 3.46Å; L1163-I1167 PolarHBondContact O-N 3.16Å
1164	S	96.5	Very high	87.1	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-60.1	-45.7	172.5	-164.6	0	0	0	0	111.6	P1046 R1049 L1160 W1161 E1162 K1166 I1167 K1168	P1046-S1164 WeakPolarHBondContact O-CB 3.29Å; P1046-S1164 PolarHBondContact O-OG 3.35Å; R1049-S1164 VanDerWaalsContact CD-OG 3.23Å; R1049-S1164 WeakPolarHBondContact CD-OG 3.43Å; R1049-S1164 VanDerWaalsContact CG-OG 3.31Å; R1049-S1164 WeakPolarHBondContact CG-OG 3.49Å; R1049-S1164 PolarHBondContact NH1-O 2.87Å; R1049-S1164 PolarHBondContact NH1-OG 3.37Å; L1160-S1164 PolarHBondContact O-N 2.88Å; W1161-S1164 WeakPolarHBondContact O-CB 3.42Å; W1161-S1164 PolarHBondContact O-N 3.17Å; E1162-S1164 VanDerWaalsContact C-N 3.32Å; E1162-S1164 PolarHBondContact O-N 2.95Å; S1164-K1166 VanDerWaalsContact C-N 3.3Å; S1164-K1166 PolarHBondContact O-N 3.3Å; S1164-I1167 PolarHBondContact O-N 2.95Å; S1164-K1168 PolarHBondContact O-N 3.04Å
1165	L	95.4	Very high	84.8	Confident	43 Å²	43	88.8 Å²	88.8	23%	0.225	44%	0.444	C	S	.	.	H	α-helix	trans	-64.3	-33.2	176.8	-71.6	179.2	0	0	0	112.6	W1161 E1162 L1163 K1168 P1169 R1170	W1161-L1165 HydrophobicContact CZ2-CD2 4.08Å; W1161-L1165 HydrophobicContact CZ2-CG 4.34Å; W1161-L1165 WeakPolarHBondContact O-CG 3.38Å; W1161-L1165 PolarHBondContact O-N 3.22Å; E1162-L1165 PolarHBondContact O-N 3.01Å; L1163-L1165 PolarHBondContact O-N 3.27Å; L1165-K1168 CarbonylContact O-C 3.58Å; L1165-K1168 VanDerWaalsContact O-C 3.25Å; L1165-P1169 VanDerWaalsContact O-CA 3.25Å; L1165-P1169 WeakPolarHBondContact O-CA 3.08Å; L1165-P1169 VanDerWaalsContact O-N 3.16Å; L1165-R1170 HydrophobicContact CD2-CG 3.82Å
1166	K	94.8	Very high	82.6	Confident	166 Å²	166	94 Å²	94	72%	0.722	47%	0.465	S	S	*	.	H	α-helix	trans	-68.7	-42.3	173.9	-174.1	-174.8	175.9	-169.4	0	112.1	E1162 L1163 S1164	E1162-K1166 WeakPolarHBondContact O-CB 3.45Å; E1162-K1166 PolarHBondContact O-N 3.24Å; L1163-K1166 HydrophobicContact CD2-CD 4.39Å; L1163-K1166 WeakPolarHBondContact O-CB 3.3Å; L1163-K1166 PolarHBondContact O-N 2.5Å; S1164-K1166 VanDerWaalsContact C-N 3.3Å; S1164-K1166 PolarHBondContact O-N 3.3Å
1167	I	94.6	Very high	80.4	Confident	54 Å²	54	95.5 Å²	95.5	28%	0.277	47%	0.468	S	S	.	.	H	α-helix	trans	-68.3	-43.1	177.7	-69.2	164.3	0	0	0	111.2	I1004 L1050 L1163 S1164	I1004-I1167 HydrophobicContact CG1-CD1 3.87Å; I1004-I1167 WeakPolarHBondContact O-CD1 3.34Å; L1050-I1167 HydrophobicContact CD2-CB 4.3Å; L1050-I1167 HydrophobicContact CD2-CG2 3.86Å; L1163-I1167 VanDerWaalsContact O-CG1 3.29Å; L1163-I1167 WeakPolarHBondContact O-CG1 3.46Å; L1163-I1167 PolarHBondContact O-N 3.16Å; S1164-I1167 PolarHBondContact O-N 2.95Å
1168	K	92.3	Very high	78.2	Confident	58 Å²	58	96.3 Å²	96.3	25%	0.252	48%	0.475	S	S	.	.	S	Bend	trans	-136.8	97.1	179.8	178.8	170.3	166.2	176	0	109.5	R1049 L1050 E1051 S1164 L1165	R1049-K1168 PolarHBondContact NH1-O 3.37Å; R1049-K1168 PolarHBondContact NH2-O 3.06Å; R1049-K1168 VanDerWaalsContact O-CD 3.29Å; R1049-K1168 WeakPolarHBondContact O-CD 3.36Å; R1049-K1168 WeakPolarHBondContact O-CE 3.19Å; R1049-K1168 PolarHBondContact O-NZ 3.46Å; L1050-K1168 HydrophobicContact CD2-CB 4.06Å; L1050-K1168 PolarHBondContact O-NZ 2.73Å; E1051-K1168 WeakPolarHBondContact OE1-CD 3.41Å; E1051-K1168 WeakPolarHBondContact OE1-CE 3.3Å; E1051-K1168 IonicContact OE1-NZ 2.91Å; E1051-K1168 PolarHBondContact OE1-NZ 3.34Å; S1164-K1168 PolarHBondContact O-N 3.04Å; L1165-K1168 CarbonylContact O-C 3.58Å; L1165-K1168 VanDerWaalsContact O-C 3.25Å
1169	P	91.3	Very high	76	Confident	91 Å²	91	100.4 Å²	100.4	59%	0.591	49%	0.486	S	S	*	.			trans	-58.3	158.6	178	-28.4	36.9	0	0	0	114	L1165	L1165-P1169 VanDerWaalsContact O-CA 3.25Å; L1165-P1169 WeakPolarHBondContact O-CA 3.08Å; L1165-P1169 VanDerWaalsContact O-N 3.16Å
1170	R	87.1	Confident	73.5	Confident	159 Å²	159	101 Å²	101	60%	0.6	50%	0.495	S	S	*	.			trans	-68.4	135.6	168.5	-79.6	169.9	169.5	161.6	-6.6	109.5	L1165 I1172	L1165-R1170 HydrophobicContact CD2-CG 3.82Å; R1170-I1172 HydrophobicContact CB-CG1 4.33Å; R1170-I1172 PolarHBondContact O-N 2.65Å
1171	N	74.2	Confident	71.2	Confident	155 Å²	155	109 Å²	109	83%	0.829	53%	0.532	S	S	*	.			trans	-73.6	66.6	-177.9	-94.6	-35.4	0	0	0	113.1	N1173	N1171-N1173 VanDerWaalsContact C-N 3.28Å; N1171-N1173 PolarHBondContact O-N 2.67Å
1172	I	64.3	Low	69	Low	110 Å²	110	112.7 Å²	112.7	56%	0.564	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-24.5	-176.9	-66.6	165.6	0	0	0	112.3	R1170 R1174 A1175	R1170-I1172 HydrophobicContact CB-CG1 4.33Å; R1170-I1172 PolarHBondContact O-N 2.65Å; I1172-R1174 PolarHBondContact O-N 2.77Å; I1172-A1175 PolarHBondContact O-N 3.49Å
1173	N	49.5	Very low	66.2	Low	128 Å²	128	114.9 Å²	114.9	68%	0.684	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-29.3	-168.1	-69.9	-14.6	0	0	0	115	N1171 A1175 K1176	N1171-N1173 VanDerWaalsContact C-N 3.28Å; N1171-N1173 PolarHBondContact O-N 2.67Å; N1173-A1175 VanDerWaalsContact C-N 3.27Å; N1173-A1175 PolarHBondContact O-N 3.16Å; N1173-K1176 PolarHBondContact O-N 3.19Å
1174	R	47.3	Very low	64.8	Low	220 Å²	220	118.1 Å²	118.1	83%	0.83	59%	0.589	S	S	*	*	H	α-helix	trans	-64.5	-28.5	177.4	-91.5	-172.2	172.6	178.9	-2	113.3	I1172 K1176 T1177	I1172-R1174 PolarHBondContact O-N 2.77Å; R1174-K1176 VanDerWaalsContact C-N 3.27Å; R1174-K1176 PolarHBondContact O-N 3.49Å; R1174-T1177 PolarHBondContact O-OG1 2.94Å
1175	A	45.3	Very low	63.1	Low	74 Å²	74	124.3 Å²	124.3	61%	0.612	62%	0.62	S	S	*	*	H	α-helix	trans	-77.6	-8.6	-179.8	0	0	0	0	0	114	I1172 N1173	I1172-A1175 PolarHBondContact O-N 3.49Å; N1173-A1175 VanDerWaalsContact C-N 3.27Å; N1173-A1175 PolarHBondContact O-N 3.16Å
1176	K	46.8	Very low	61.3	Low	155 Å²	155	128.8 Å²	128.8	67%	0.674	64%	0.642	S	S	*	*	H	α-helix	trans	-101.4	-32.4	178.3	-72.5	-171.8	175.8	-177.7	0	113.5	N1173 R1174 R1179 G1180	N1173-K1176 PolarHBondContact O-N 3.19Å; R1174-K1176 VanDerWaalsContact C-N 3.27Å; R1174-K1176 PolarHBondContact O-N 3.49Å; K1176-R1179 PolarHBondContact O-N 3.31Å; K1176-G1180 PolarHBondContact O-N 3.26Å; K1176-G1180 VanDerWaalsContact O-N 3.08Å
1177	T	46.5	Very low	59.3	Low	86 Å²	86	126.6 Å²	126.6	53%	0.528	64%	0.637	S	S	.	*	H	α-helix	trans	-68.5	-47.2	177.3	47.7	0	0	0	0	111.9	R1174 R1179 G1180 E1181	R1174-T1177 PolarHBondContact O-OG1 2.94Å; T1177-R1179 PolarHBondContact O-N 3.25Å; T1177-R1179 VanDerWaalsContact O-N 3.07Å; T1177-G1180 PolarHBondContact O-N 2.78Å; T1177-E1181 PolarHBondContact O-N 3.02Å; T1177-E1181 VanDerWaalsContact O-N 3.08Å
1178	D	44	Very low	57.1	Low	99 Å²	99	131.1 Å²	131.1	53%	0.529	66%	0.659	S	S	.	*	H	α-helix	trans	-69.4	-7.9	-180	-159.4	4.2	0	0	0	113.6	K1182	D1178-K1182 IonicContact OD1-NZ 2.7Å; D1178-K1182 PolarHBondContact OD1-NZ 2.73Å
1179	R	47.3	Very low	54.8	Low	208 Å²	208	136 Å²	136	79%	0.785	69%	0.687	S	S	*	*	H	α-helix	trans	-103.1	-13	167.6	-97.7	-172.4	173.5	-169.6	-1	114.3	K1176 T1177	K1176-R1179 PolarHBondContact O-N 3.31Å; T1177-R1179 PolarHBondContact O-N 3.25Å; T1177-R1179 VanDerWaalsContact O-N 3.07Å
1180	G	43.3	Very low	52.2	Low	46 Å²	46	139.2 Å²	139.2	47%	0.474	69%	0.693	S	S	.	*	H	α-helix	trans	-91.4	-26	176.4	0	0	0	0	0	113.4	K1176 T1177 K1182	K1176-G1180 PolarHBondContact O-N 3.26Å; K1176-G1180 VanDerWaalsContact O-N 3.08Å; T1177-G1180 PolarHBondContact O-N 2.78Å; G1180-K1182 PolarHBondContact O-N 3.29Å
1181	E	47.5	Very low	49.5	Very low	169 Å²	169	137.7 Å²	137.7	79%	0.79	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	15.1	177.2	-63.1	-179.1	148.4	0	0	113.1	T1177	T1177-E1181 PolarHBondContact O-N 3.02Å; T1177-E1181 VanDerWaalsContact O-N 3.08Å
1182	K	47.8	Very low	47.4	Very low	155 Å²	155	136.3 Å²	136.3	67%	0.674	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	32.2	-177.9	-71.5	178.1	-176.9	134.1	0	113.4	D1178 G1180	D1178-K1182 IonicContact OD1-NZ 2.7Å; D1178-K1182 PolarHBondContact OD1-NZ 2.73Å; G1180-K1182 PolarHBondContact O-N 3.29Å
1183	T	39.4	Very low	45.9	Very low	185 Å²	185	138.6 Å²	138.6	100%	1.135	70%	0.701	S	S	*	*			trans	-140.7	0	172.1	52.4	0	0	0	0	110.7

Retrieved 1,183 of 1,183 residues in 249.2 ms (Link to these results)

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